SCHEMBL4072937

SCHEMBL4072937

CC(=O)c1cnc(Nc2ccc(N3CCN(OC(=O)OC(C)(C)C)CC3)cn2)nc1NC1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.51
CDK4 P11802 5/20 0.47
CCND1 P24385 5/20 0.47
CCND3 P30281 4/20 0.47
CCNA2 P20248 3/20 0.47
CDK2 P24941 3/20 0.47
CDK6 Q00534 3/20 0.47
CDK1 P06493 2/20 0.47
CCNB1 P14635 2/20 0.47
CDK7 P50613 2/20 0.47
CCNH P51946 2/20 0.47
CCNT1 O60563 2/20 0.46
CDK9 P50750 2/20 0.46
CCND2 P30279 1/20 0.45

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
SCHEMBL4068785 0.90 AURKA (0.46) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4063982 0.90 SYK (0.56) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4070490 0.89 CDK4 (0.45) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4067757 0.82 CDK4 (0.64) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4071155 0.81 SYK (0.53) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4071154 0.81 SYK (0.53) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4068180 0.80 SYK (0.53) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4071068 0.79 SYK (0.51) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4065950 0.79 SYK (0.53) SYKCDK4CCND1CCND3CCNA2
SCHEMBL4073699 0.78 SYK (0.51) SYKCDK4CCND1CCND3CCNA2

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-1590341-B1 2-AMINOPYRIDINE SUBSTITUTED HETEROCYCLES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2009-06-17 EP claimed