SCHEMBL5380307

SCHEMBL5380307

Cc1oc(-c2ccccc2)nc1COc1ccc(Cn2cc(CCC(=O)O)c(-c3ccc(F)cc3)n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.64
PPARG P37231 19/20 0.53
PPARA Q07869 16/20 0.53
PPARD Q03181 1/20 0.53

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
SCHEMBL5387534 0.95 FFAR1 (0.70) FFAR1PPARGPPARAPPARD
SCHEMBL5376961 0.93 FFAR1 (0.65) FFAR1PPARGPPARA
SCHEMBL5376872 0.93 FFAR1 (0.53) FFAR1PPARGPPARAPPARD
SCHEMBL5384782 0.92 FFAR1 (0.61) FFAR1PPARGPPARAPPARD
SCHEMBL5376697 0.91 FFAR1 (0.65) FFAR1PPARGPPARAPPARD
SCHEMBL5392037 0.90 FFAR1 (0.65) FFAR1PPARGPPARA
SCHEMBL5377287 0.90 FFAR1 (0.51) FFAR1PPARGPPARAPPARD
SCHEMBL5380371 0.90 PPARG (0.60) FFAR1PPARGPPARAPPARD
SCHEMBL5378976 0.90 FFAR1 (0.64) FFAR1PPARGPPARA
SCHEMBL5397311 0.88 FFAR1 (0.59) FFAR1PPARGPPARA

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