SCHEMBL8326420

SCHEMBL8326420

CSc1ncc2c(n1)CCc1cnc(-c3ccc(Cl)cc3)nc1-2

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 17/20 0.67
CDK2 P24941 17/20 0.67
CDK1 P06493 1/20 0.45
CDK7 P50613 1/20 0.45
CDK5 Q00535 1/20 0.45
DUSP10 Q9Y6W6 1/20 0.38
AURKA O14965 1/20 0.38
KDR P35968 1/20 0.38
AURKB Q96GD4 1/20 0.38

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
SCHEMBL8325285 0.85 CCNA2 (0.54) CCNA2CDK2CDK1CDK7CDK5
SCHEMBL8329082 0.84 CCNA2 (0.48) CCNA2CDK2
SCHEMBL8325184 0.81 CCNA2 (0.62) CCNA2CDK2
SCHEMBL8326575 0.81 CCNA2 (0.58) CCNA2CDK2CDK1CDK7CDK5
SCHEMBL8327901 0.81 CCNA2 (0.46) CCNA2CDK2
SCHEMBL8580105 0.79 CCNA2 (0.44) CCNA2CDK2
SCHEMBL8324679 0.78 CCNA2 (0.59) CCNA2CDK2CDK1CDK7CDK5
SCHEMBL8329431 0.78 CCNA2 (0.44) CCNA2CDK2
SCHEMBL8330251 0.75 DUSP10 (0.45) CCNA2CDK2DUSP10
SCHEMBL8327091 0.74 CCNA2 (0.51) CCNA2CDK2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915879-A1 NOVEL COMPOUNDS Astra Pharmaceuticals Limited (GB) 1999-05-19 EP claimed
WO-1998001449-A1 NOVEL COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1998-01-15 WO claimed
EP-0915879-A1 NOVEL COMPOUNDS Astra Pharmaceuticals Limited (GB) 1999-05-19 EP disclosed
WO-1998001449-A1 NOVEL COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1998-01-15 WO disclosed