SCHEMBL28876388

SCHEMBL28876388

CCc1cn(C2CC2)nc1-c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 7/20 0.43
CSNK1E P49674 7/20 0.43
MAPK14 Q16539 2/20 0.39
MAPK13 O15264 1/20 0.39
MAPK12 P53778 1/20 0.39
MAPK11 Q15759 1/20 0.39
TGFBR1 P36897 1/20 0.38
MERTK Q12866 1/20 0.38
SLC34A1 Q06495 1/20 0.37
ALDH1A1 P00352 3/20 0.36
CYP1A2 P05177 3/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL1555194 0.77 CSNK1D (0.42) CSNK1DCSNK1EMAPK14MAPK13MAPK12
SCHEMBL16204217 0.77 PRMT1 (0.39) CSNK1DCSNK1ETGFBR1MAPK1MEN1
SCHEMBL21753546 0.74 CSF1R (0.45) CSNK1DCSNK1EMAPK14TGFBR1ALDH1A1
SCHEMBL21753533 0.72 CSNK1D (0.47) CSNK1DCSNK1EMAPK14MAPK13MAPK12
SCHEMBL16201357 0.72 KMT2A (0.40) TGFBR1ALDH1A1MAPK1MEN1KMT2A
SCHEMBL29902525 0.71 BTK (0.52) CSNK1DCSNK1ETGFBR1BTK
SCHEMBL1555110 0.70 LPL (0.44) CSNK1DCSNK1EMAPK14MAPK13MAPK12
SCHEMBL25237034 0.70 LRRK2 (0.34)
SCHEMBL23584998 0.70 DRD2 (0.42) CSNK1DCSNK1EMAPK14MAPK13MAPK12
SCHEMBL20075127 0.69 SLC34A1 (0.49) CSNK1DCSNK1EMAPK14MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110191884-A Substituted 6- (1H-pyrazol-1-yl) pyrimidine-4-amine derivatives and uses thereof 拜耳公司 2019-08-30 CN disclosed