SCHEMBL5385889

SCHEMBL5385889

CCOC(=O)c1cn(Cc2ccc(OCc3nc(-c4ccccc4)oc3C)cc2)nc1O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.57
PPARG P37231 15/20 0.53
PPARA Q07869 13/20 0.53
KDR P35968 1/20 0.47

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
SCHEMBL5376864 0.90 FFAR1 (0.55) FFAR1PPARGPPARAKDR
SCHEMBL4851691 0.89 FFAR1 (0.54) FFAR1PPARGPPARAKDR
SCHEMBL5377223 0.86 FFAR1 (0.51) FFAR1PPARGPPARAKDR
SCHEMBL5380800 0.86 PPARA (0.53) FFAR1PPARGPPARA
SCHEMBL5374736 0.85 FFAR1 (0.58) FFAR1PPARGPPARAKDR
SCHEMBL5381904 0.85 FFAR1 (0.62) FFAR1PPARGPPARAKDR
SCHEMBL5376737 0.83 FFAR1 (0.58) FFAR1PPARGPPARAKDR
SCHEMBL3986322 0.83 FFAR1 (0.48) FFAR1PPARGPPARAKDR
SCHEMBL5377260 0.83 FFAR1 (0.70) FFAR1PPARGPPARA
SCHEMBL4847694 0.83 KDR (0.57) FFAR1PPARGPPARAKDR

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
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