SCHEMBL6943178

SCHEMBL6943178

Cc1cc(Nc2ncc3c(C)cc(=O)n(C(C)C)c3n2)ccc1F

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 11/20 0.63
CCND1 P24385 11/20 0.63
CCND2 P30279 10/20 0.63
CCND3 P30281 10/20 0.63
FGFR1 P11362 3/20 0.48
EGFR P00533 1/20 0.48
PDGFRB P09619 1/20 0.48
SRC P12931 1/20 0.48
PDGFRA P16234 1/20 0.48
STAT5A P42229 1/20 0.48
ACVR1 Q04771 1/20 0.48
PKMYT1 Q99640 1/20 0.48
CDK2 P24941 5/20 0.45
AURKA O14965 1/20 0.44
LIMK1 P53667 1/20 0.44
AURKB Q96GD4 1/20 0.44
KCNH2 Q12809 5/20 0.44
CCNB2 O95067 2/20 0.43
CDK1 P06493 2/20 0.43
CCNB1 P14635 2/20 0.43

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
SCHEMBL6808572 0.86 CDK4 (0.66) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL6944082 0.81 CDK4 (0.50) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL6943183 0.81 CDK4 (0.52) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL6945124 0.79 CDK4 (0.70) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL6944074 0.79 CDK4 (0.72) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL7077958 0.78 CDK4 (1.00) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL6939778 0.77 CDK4 (0.64) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL6940711 0.77 CDK4 (0.77) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL6807699 0.76 CDK4 (0.69) CDK4CCND1CCND2CCND3FGFR1
SCHEMBL6807701 0.75 CDK4 (0.70) CDK4CCND1CCND2CCND3FGFR1

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-1268476-A1 5-ALKYLPYRIDO[2,3-D]PYRIMIDINES TYROSINE KINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2003-01-02 EP claimed
WO-2001070741-A1 5-ALKYLPYRIDO[2,3-D]PYRIMIDINES TYROSINE KINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-09-27 WO claimed
EP-1268476-A1 5-ALKYLPYRIDO[2,3-D]PYRIMIDINES TYROSINE KINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2003-01-02 EP disclosed
WO-2001070741-A1 5-ALKYLPYRIDO[2,3-D]PYRIMIDINES TYROSINE KINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-09-27 WO disclosed