SCHEMBL9922544

SCHEMBL9922544

Cc1ccc(C[C@H](N)CNc2ncc(-c3ccc4cnc(N)cc4c3)s2)cc1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 20/20 0.79
CDK2 P24941 12/20 0.79
CDK1 P06493 1/20 0.47
KIT P10721 1/20 0.47
KDR P35968 1/20 0.47
SGK1 O00141 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4294051 0.90 AKT1 (0.79) AKT1CDK2CDK1KITKDR
SCHEMBL4294061 0.90 AKT1 (0.79) AKT1CDK2CDK1KITKDR
SCHEMBL4294058 0.90 AKT1 (0.79) AKT1CDK2CDK1KITKDR
SCHEMBL12064679 0.89 AKT1 (0.64) AKT1CDK2CDK1KITKDR
SCHEMBL4300777 0.88 AKT1 (1.00) AKT1CDK2CDK1KITKDR
SCHEMBL4300774 0.88 AKT1 (1.00) AKT1CDK2CDK1KITKDR
SCHEMBL4300782 0.88 AKT1 (1.00) AKT1CDK2CDK1KITKDR
SCHEMBL12241486 0.81 AKT1 (0.62) AKT1CDK2CDK1KITKDR
SCHEMBL12241768 0.81 AKT1 (0.62) AKT1CDK2CDK1KITKDR
SCHEMBL4362069 0.81 AKT1 (0.62) AKT1CDK2CDK1KITKDR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981884-B1 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS AMGEN INC (US) 2012-06-13 EP disclosed