SCHEMBL1866751

SCHEMBL1866751

CCSc1cc(=O)c2cc(C(=O)OC)cc(CCNc3cc(F)cc(F)c3)c2o1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 15/20 0.41
▸ PIK3CD O00329 9/20 0.41
▸ PIK3CA P42336 9/20 0.41
▸ PIK3CG P48736 9/20 0.41
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ GPR35 Q9HC97 2/20 0.34
▸ NQO2 P16083 1/20 0.32

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
SCHEMBL1870074 0.82 PIK3CB (0.39) PIK3CBPIK3CDPIK3CAPIK3CGGPR35
SCHEMBL1639065 0.80 PIK3CB (0.52) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL1637326 0.75 CSNK2A2 (0.37) KDM4EALDH1A1TSHRHSD17B10
SCHEMBL1869001 0.75 PIK3CB (0.56) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL24713822 0.74 KDM4E (0.35) KDM4EALDH1A1TSHRHSD17B10GPR35
SCHEMBL23886985 0.74 PIK3CA (0.40) PIK3CAALDH1A1HSD17B10GPR35
SCHEMBL23886970 0.74 CCNE2 (0.35) GPR35
SCHEMBL23887223 0.74 KDM4E (0.42) PIK3CAKDM4EALDH1A1HSD17B10
SCHEMBL24713633 0.73 TNKS (0.36) PIK3CBPIK3CDPIK3CAPIK3CGKDM4E
SCHEMBL24714348 0.73 KDM4E (0.35) PIK3CBPIK3CDPIK3CAPIK3CGKDM4E

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-2493870-A1 CHROMENONE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY AstraZeneca AB (SE) 2012-09-05 — — EP disclosed
WO-2011051704-A1 CHROMENONE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY ASTRAZENECA AB (SE) 2011-05-05 — — WO disclosed
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