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Murcko scaffold

Ring system with 4 rings and 21 atoms

28 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
21
Chemicals
28
With full pages
4
Scaffold SMILES

c1ccc(-c2ccnc3c2cnn3-c2ccccc2)cc1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffold
Murcko scaffold c1ccc(-c2ccnc3c2cnn3-c2ccccc2)cc1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 28 of 28 chemicals

RefChem:380561 chemical structure, C20H14FN5, CAS 887396-42-1
RefChem:380561
CAS 887396-42-1C20H14FN5
6-Amino-1-(3,4-dimethylphenyl)-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C23H21N5O2, CAS 896071-10-6
6-Amino-1-(3,4-dimethylphenyl)-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 896071-10-6C23H21N5O2
6-Amino-4-(4-methoxyphenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C21H17N5O, CAS 258340-66-8
6-Amino-4-(4-methoxyphenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 258340-66-8C21H17N5O
6-Amino-4-(3,4-dihydroxyphenyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C20H14FN5O2, CAS 885179-39-5
6-Amino-4-(3,4-dihydroxyphenyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 885179-39-5C20H14FN5O2
6-Amino-4-(2-hydroxy-3-methoxyphenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C21H17N5O2, CAS 885179-18-0
6-Amino-4-(2-hydroxy-3-methoxyphenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 885179-18-0C21H17N5O2
6-Amino-4-(3,4-dimethoxyphenyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C22H18FN5O2, CAS 899414-67-6
6-Amino-4-(3,4-dimethoxyphenyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 899414-67-6C22H18FN5O2
6-Amino-3-methyl-1-(4-methylphenyl)-4-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C24H23N5O3, CAS 885179-32-8
6-Amino-3-methyl-1-(4-methylphenyl)-4-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 885179-32-8C24H23N5O3
6-Amino-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-1-(p-tolyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C22H19N5O2, CAS 885179-25-9
6-Amino-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-1-(p-tolyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 885179-25-9C22H19N5O2
6-Amino-4-(3,4-dimethoxyphenyl)-3-methyl-1-(p-tolyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C23H21N5O2, CAS 899386-25-5
6-Amino-4-(3,4-dimethoxyphenyl)-3-methyl-1-(p-tolyl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 899386-25-5C23H21N5O2
6-Amino-4-(3,4-dihydroxyphenyl)-1-(3,4-dimethylphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C22H19N5O2, CAS 900267-66-5
6-Amino-4-(3,4-dihydroxyphenyl)-1-(3,4-dimethylphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 900267-66-5C22H19N5O2
4-(4-Methoxyphenyl)-3-methyl-6-(2-oxopropoxy)-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C24H20N4O3, CAS 496971-22-3
4-(4-Methoxyphenyl)-3-methyl-6-(2-oxopropoxy)-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 496971-22-3C24H20N4O3
Agn-PC-0N762Z chemical structure, C20H15N5, CAS 198637-71-7
Agn-PC-0N762Z
CAS 198637-71-7C20H15N5
Agn-PC-0nax3W chemical structure, C20H14ClN5, CAS 258340-67-9
Agn-PC-0nax3W
CAS 258340-67-9C20H14ClN5
Agn-PC-0nbbxo chemical structure, C20H14N6O2, CAS 258340-68-0
Agn-PC-0nbbxo
CAS 258340-68-0C20H14N6O2
6-Amino-3-methyl-4-(4-methylphenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C21H17N5, CAS 948239-00-7
6-Amino-3-methyl-4-(4-methylphenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 948239-00-7C21H17N5
6-Amino-4-(4-bromophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C20H14BrN5, CAS 887396-43-2
6-Amino-4-(4-bromophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 887396-43-2C20H14BrN5
6-Heptenoic acid, 3,5-dihydroxy-7-(4-(4-fluorophenyl)-3-methyl-6-(1-methylethyl)-1-phenyl-1H-pyrazolo(3,4-b)pyridin-5-yl)-, monosodium salt chemical structure, C29H29FN3NaO4, CAS 126273-96-9
6-Heptenoic acid, 3,5-dihydroxy-7-(4-(4-fluorophenyl)-3-methyl-6-(1-methylethyl)-1-phenyl-1H-pyrazolo(3,4-b)pyridin-5-yl)-, monosodium salt
CAS 126273-96-9C29H29FN3NaO4
6-Amino-4-(2-chlorophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C20H14ClN5, CAS 887396-41-0
6-Amino-4-(2-chlorophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 887396-41-0C20H14ClN5
6-Amino-4-(2-bromophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C20H14BrN5, CAS 1103593-91-4
6-Amino-4-(2-bromophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 1103593-91-4C20H14BrN5
6-Amino-4-(2-fluorophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile chemical structure, C20H14FN5, CAS 1103593-92-5
6-Amino-4-(2-fluorophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CAS 1103593-92-5C20H14FN5
Ethyl 4-(4-bromophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate chemical structure, C22H18BrN3O2, CAS 1365964-70-0
Ethyl 4-(4-bromophenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate
CAS 1365964-70-0C22H18BrN3O2
4-(4-Methoxyphenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid chemical structure, C21H17N3O3, CAS 926282-55-5
4-(4-Methoxyphenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
CAS 926282-55-5C21H17N3O3
4-[4-(Dimethylamino)phenyl]-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid chemical structure, C22H20N4O2, CAS 1442526-74-0
4-[4-(Dimethylamino)phenyl]-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
CAS 1442526-74-0C22H20N4O2
4-(4-(Dimethylamino)phenyl)-3-isopropyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid chemical structure, C24H24N4O2, CAS 2093983-32-3
4-(4-(Dimethylamino)phenyl)-3-isopropyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
CAS 2093983-32-3C24H24N4O2