SCHEMBL5264992

SCHEMBL5264992

Cc1nc(Nc2ccc(-n3cccn3)cc2)nc2c1ccc(=O)n2C1CC2CCC1C2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 12/20 0.51
CCND1 P24385 9/20 0.51
CCND2 P30279 9/20 0.51
CCND3 P30281 9/20 0.51
CCNE2 O96020 2/20 0.45
CCNA2 P20248 2/20 0.45
CCNE1 P24864 2/20 0.45
CDK2 P24941 2/20 0.45
CCNA1 P78396 2/20 0.45
FGFR1 P11362 1/20 0.45
FGFR2 P21802 1/20 0.45
FGFR4 P22455 1/20 0.45
FGFR3 P22607 1/20 0.45
CDK6 Q00534 2/20 0.42
JAK3 P52333 1/20 0.40
AURKA O14965 1/20 0.40
CSF1R P07333 1/20 0.38
SYK P43405 1/20 0.38
AXL P30530 2/20 0.36
KDR P35968 1/20 0.36

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
SCHEMBL5265339 0.86 CDK4 (0.68) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL3341336 0.85 CDK4 (0.49) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL5264675 0.84 CDK4 (0.73) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL5269512 0.83 CDK4 (0.62) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL6812292 0.83 CDK4 (0.74) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL3971192 0.78 CDK4 (0.58) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL6642680 0.75 CDK4 (0.50) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL5266487 0.72 CCND1 (0.55) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL5267350 0.71 JAK3 (0.56) CDK4CCND1CCND2CCND3CCNE2
SCHEMBL5266348 0.71 JAK3 (0.52) CDK4CCND1CCND2CCND3CCNE2

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-1806348-A2 Pyrido (2,3-D)Pyrimidines as inhibitors of cellular proliferation Warner-Lambert Company LLC (US) 2007-07-11 EP disclosed
US-6498163-B1 POTENT INHIBITORS OF CYCLIN-DEPENDENT KINASES AND GROWTH FACTOR MEDIATED KINASES; CANCER, RESTENOSIS, ATHEROSCLEROSIS WARNER-LAMBERT COMPANY 2002-12-24 US disclosed
EP-0964864-A2 PYRIDO 2,3-D] PYRIMIDINES AND 4-AMINOPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1999-12-22 EP disclosed
WO-1998033798-A2 PYRIDO[2,3-D]PYRIMIDINES AND 4-AMINO-PYRIMIDINES AS INHIBITORS OF CELL PROLIFERATION WARNER LAMBERT COMPANY (US) 1998-08-06 WO disclosed