SCHEMBL5379449

SCHEMBL5379449

Cc1oc(-c2ccccc2)nc1COc1ccc(Cn2cc(C(C)(C(=O)O)C(=O)O)c(-c3cccs3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.51
PPARA Q07869 18/20 0.49
PPARG P37231 16/20 0.48
PPARD Q03181 7/20 0.48

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
SCHEMBL5380963 0.88 FFAR1 (0.54) FFAR1PPARAPPARGPPARD
SCHEMBL7547490 0.88 PPARA (0.52) FFAR1PPARAPPARGPPARD
SCHEMBL7488571 0.87 PPARA (0.48) FFAR1PPARAPPARGPPARD
SCHEMBL5378969 0.86 FFAR1 (0.54) FFAR1PPARAPPARGPPARD
SCHEMBL7488575 0.86 FFAR1 (0.47) FFAR1PPARAPPARGPPARD
SCHEMBL5385326 0.85 FFAR1 (0.49) FFAR1PPARAPPARGPPARD
SCHEMBL5387616 0.85 FFAR1 (0.50) FFAR1PPARAPPARGPPARD
SCHEMBL5382440 0.85 FFAR1 (0.62) FFAR1PPARAPPARGPPARD
SCHEMBL5380800 0.85 PPARA (0.53) FFAR1PPARAPPARGPPARD
SCHEMBL5379443 0.85 PPARA (0.55) FFAR1PPARAPPARGPPARD

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