SCHEMBL27428607

SCHEMBL27428607

CCc1nccc(=O)n1CC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 8/20 0.37
CCND1 P24385 8/20 0.37
CCND2 P30279 8/20 0.37
CCND3 P30281 8/20 0.37
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CCNB2 O95067 1/20 0.34
CCNE2 O96020 1/20 0.34
CDK1 P06493 1/20 0.34
FGFR1 P11362 1/20 0.34
SRC P12931 1/20 0.34
CCNB1 P14635 1/20 0.34
CCNA2 P20248 1/20 0.34
FGFR2 P21802 1/20 0.34
FGFR4 P22455 1/20 0.34
FGFR3 P22607 1/20 0.34

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
SCHEMBL13242252 0.78 PDE4A (0.37) ALDH1A1LMNAMAPK1GSK3BADORA3
SCHEMBL761973 0.78 CDK4 (0.38) CDK4CCND1CCND2CCND3ALDH1A1
SCHEMBL28136429 0.76 CDK4 (0.37) CDK4CCND1CCND2CCND3ALDH1A1
SCHEMBL761369 0.76 CDK4 (0.41) CDK4CCND1CCND2CCND3ALDH1A1
SCHEMBL27480564 0.73 CDK4 (0.36) CDK4CCND1CCND2CCND3ALDH1A1
SCHEMBL761987 0.71 KDM4E (0.49) CDK4CCND1CCND2CCND3ALDH1A1
SCHEMBL1483873 0.68 SMN1; SMN2 (0.41) ALDH1A1LMNAHPGDHSD17B10GSK3B
SCHEMBL27396922 0.68 BTK (0.38) CDK4CCND1CCND2CCND3ALDH1A1
SCHEMBL9378857 0.67 CDK4 (0.52) CDK4CCND1CCND2CCND3ALDH1A1
SCHEMBL19862684 0.65 POLB (0.38) ALDH1A1KDM4ELMNAHPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102216279-A Phenyl pyrimidone compounds, pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO LTD 2011-10-12 CN claimed
CN-102216279-A Phenyl pyrimidone compounds, pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO LTD 2011-10-12 CN disclosed
CN-1109879-A 2-arylpyrimidines and herbicidal use thereof ROHM & HAAS (US) 1995-10-11 CN disclosed