SCHEMBL19782920

SCHEMBL19782920

COc1cc(-c2cc(-c3ccc(C)cc3)nc(=O)[nH]2)ccc1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL12 P48061 2/20 0.72
CSNK2A2 P19784 3/20 0.54
CSNK2B P67870 3/20 0.54
CSNK2A1 P68400 3/20 0.54
CDC7 O00311 2/20 0.54
PIM1 P11309 2/20 0.54
CLK1 P49759 1/20 0.54
GSK3B P49841 1/20 0.54
CSNK2A3 Q8NEV1 1/20 0.54
KDM4E B2RXH2 2/20 0.53
RIPK1 Q13546 1/20 0.50
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 1/20 0.46
RECQL P46063 1/20 0.46
GFER P55789 1/20 0.46
PDGFRB P09619 1/20 0.46
KIT P10721 1/20 0.46
KDR P35968 1/20 0.46

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
SCHEMBL19782360 0.91 CXCL12 (0.74) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL19782359 0.90 CXCL12 (0.72) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL19782680 0.90 CXCL12 (0.72) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL19782808 0.89 CXCL12 (0.71) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL19783008 0.89 CXCL12 (0.74) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL19782832 0.89 CXCL12 (0.71) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL19782800 0.89 CXCL12 (0.71) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL19782686 0.89 CXCL12 (0.91) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL22065542 0.88 CXCL12 (0.69) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7
SCHEMBL19782681 0.87 CXCL12 (0.71) CXCL12CSNK2A2CSNK2BCSNK2A1CDC7

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
WO-2018011376-A1 PYRIMIDINONE DERIVATIVES AND USES THEREOF TO NEUTRALIZE THE BIOLOGICAL ACTIVITY OF CHEMOKINES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE - CNRS - (FR) 2018-01-18 WO disclosed