SCHEMBL6943064

SCHEMBL6943064

Cc1c(Br)c(=O)n(C2CCCC2)c2nc(Nc3ccc(N4CCOCC4)cc3)ncc12

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 20/20 0.82
CCND1 P24385 20/20 0.82
CCND2 P30279 16/20 0.82
CCND3 P30281 16/20 0.82
CCNA2 P20248 9/20 0.82
CDK2 P24941 9/20 0.82
CCNA1 P78396 6/20 0.82
CCNB2 O95067 5/20 0.82
CDK1 P06493 5/20 0.82
CCNB1 P14635 5/20 0.82
CCNB3 Q8WWL7 5/20 0.82
CCNE2 O96020 5/20 0.82
CCNE1 P24864 5/20 0.82
FGFR1 P11362 3/20 0.82
FGFR2 P21802 3/20 0.82
FGFR4 P22455 3/20 0.82
FGFR3 P22607 3/20 0.82
CDK6 Q00534 1/20 0.65
NUAK1 O60285 1/20 0.63
PDGFRB P09619 1/20 0.63

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
SCHEMBL4828630 0.91 CDK4 (1.00) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5750343 0.91 CDK4 (0.71) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL29507436 0.91 CDK4 (1.00) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL6945910 0.90 CDK4 (1.00) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL6938615 0.89 CDK4 (0.82) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL6944941 0.89 CDK4 (0.79) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL6943792 0.88 CDK4 (0.68) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL7079324 0.88 CDK4 (0.77) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL7077957 0.88 CDK4 (0.95) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL6945970 0.88 CDK4 (0.67) CDK4CCND1CCND2CCND3CCNA2

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