SCHEMBL7008947

SCHEMBL7008947

CCn1c(=O)ccc2cncnc21

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 20/20 0.56
CCND1 P24385 20/20 0.56
CCND2 P30279 20/20 0.56
CCND3 P30281 20/20 0.56
CCNB2 O95067 1/20 0.51
CCNE2 O96020 1/20 0.51
CDK1 P06493 1/20 0.51
FGFR1 P11362 1/20 0.51
SRC P12931 1/20 0.51
CCNB1 P14635 1/20 0.51
CCNA2 P20248 1/20 0.51
FGFR2 P21802 1/20 0.51
FGFR4 P22455 1/20 0.51
FGFR3 P22607 1/20 0.51
CCNE1 P24864 1/20 0.51
CDK2 P24941 1/20 0.51
CCNA1 P78396 1/20 0.51
CCNB3 Q8WWL7 1/20 0.51

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
SCHEMBL29830539 1.00 CDK4 (0.56) CDK4CCND1CCND2CCND3CCNB2
SCHEMBL29830517 0.87 CDK4 (0.53) CDK4CCND1CCND2CCND3CCNB2
SCHEMBL29830317 0.83 CDK4 (0.54) CDK4CCND1CCND2CCND3CCNB2
SCHEMBL29830311 0.83 CDK4 (0.44) CDK4CCND1CCND2CCND3CCNB2
SCHEMBL29830387 0.81 CDK4 (0.40) CDK4CCND1CCND2CCND3CCNB2
SCHEMBL29830824 0.80 CDK4 (0.42) CDK4CCND1CCND2CCND3CCNB2
SCHEMBL30719007 0.80 CYP1A2 (0.56) CDK4CCND1CCND2CCND3
SCHEMBL29830646 0.80 CDK4 (0.41) CDK4CCND1CCND2CCND3CCNB2
SCHEMBL8328996 0.77 CDK4 (0.48) CDK4CCND1CCND2CCND3
SCHEMBL29542651 0.77 CDK4 (0.48) CDK4CCND1CCND2CCND3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307450-A2 2-(4-PYRDYL)AMINO-6-DIALKOXYPHENYL-PYRIDO(2.3-D)PYRIMIDIN-7-ONES WARNER-LAMBERT COMPANY (US) 2003-05-07 EP claimed
WO-2002012238-A2 2-(4-PYRIDYL)AMINO-6-DIALKOXYPHENYL-PYRIDO[2,3-d]PYRIMIDIN-7-ONES WARNER-LAMBERT COMPANY (US) 2002-02-14 WO claimed