SCHEMBL5377215

SCHEMBL5377215

CCOc1cc(CCl)ccc1OCc1nc(-c2ccccc2)oc1C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.52
FFAR1 O14842 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.47
PPARG P37231 9/20 0.46
PPARA Q07869 8/20 0.46
TP53 P04637 2/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PPARD Q03181 1/20 0.43

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
SCHEMBL1731684 0.90 KDR (0.53) KDRFFAR1SMN1; SMN2PPARGPPARA
SCHEMBL4034512 0.90 KDR (0.53) KDRFFAR1SMN1; SMN2PPARGPPARA
SCHEMBL5382506 0.89 KDR (0.66) KDRFFAR1SMN1; SMN2PPARGPPARA
SCHEMBL4854118 0.88 TP53 (0.50) KDRFFAR1SMN1; SMN2PPARGPPARA
SCHEMBL4845689 0.84 PPARG (0.53) SMN1; SMN2PPARGPPARATP53MAPT
SCHEMBL5399780 0.82 KDR (0.65) KDRFFAR1PPARGPPARAMAPT
SCHEMBL7564833 0.82 KDR (0.65) KDRFFAR1PPARGPPARAMAPT
SCHEMBL5372453 0.82 KDR (0.48) KDRFFAR1SMN1; SMN2PPARGPPARA
SCHEMBL1732533 0.80 KDM4E (0.49) KDRFFAR1SMN1; SMN2PPARGPPARA
SCHEMBL4035773 0.80 FFAR1 (0.69) KDRFFAR1PPARGPPARAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7179823-B1 5-membered n-heterocyclic compounds with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-20 US disclosed
EP-1457490-A1 5-membered N-heterocyclic compounds with hypoglycemic and hypolipidemic activity Takeda Chemical Industries, Ltd. (JP) 2004-09-15 EP disclosed
EP-1228067-B1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-07-14 EP disclosed
EP-1228067-A1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGYLCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 2002-08-07 EP disclosed
WO-2001038325-A1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-31 WO disclosed