SCHEMBL5380604

SCHEMBL5380604

CCOC(=O)CCc1cn(Cc2ccc(OCc3nc(-c4ccccc4)oc3C)cc2)nc1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.56
PPARG P37231 16/20 0.49
PPARA Q07869 15/20 0.49
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
SCHEMBL5371978 0.95 FFAR1 (0.57) FFAR1PPARGPPARAKDR
SCHEMBL5393704 0.93 FFAR1 (0.52) FFAR1PPARGPPARAKDR
SCHEMBL5371853 0.93 FFAR1 (0.56) FFAR1PPARGPPARAKDR
SCHEMBL5410288 0.92 FFAR1 (0.67) FFAR1PPARGPPARAKDR
SCHEMBL5376948 0.92 FFAR1 (0.67) FFAR1PPARGPPARAKDR
SCHEMBL5377270 0.91 FFAR1 (0.54) FFAR1PPARGPPARAKDR
SCHEMBL5382046 0.90 FFAR1 (0.44) FFAR1PPARGPPARAKDR
SCHEMBL5409251 0.90 PPARG (0.47) FFAR1PPARGPPARA
SCHEMBL5374736 0.90 FFAR1 (0.58) FFAR1PPARGPPARAKDR
SCHEMBL5376899 0.89 FFAR1 (0.60) 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