SCHEMBL5378969

SCHEMBL5378969

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

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.54
PPARA Q07869 15/20 0.51
PPARG P37231 15/20 0.49
PPARD Q03181 3/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL5382440 0.92 FFAR1 (0.62) FFAR1PPARAPPARGPPARD
SCHEMBL5387616 0.91 FFAR1 (0.50) FFAR1PPARAPPARGPPARDKDM4E
SCHEMBL5379443 0.91 PPARA (0.55) FFAR1PPARAPPARGPPARD
SCHEMBL6829769 0.90 FFAR1 (0.51) FFAR1PPARAPPARGPPARDMAPT
SCHEMBL5396924 0.90 FFAR1 (0.61) FFAR1PPARAPPARGKDM4E
SCHEMBL6829766 0.90 FFAR1 (0.50) FFAR1PPARAPPARGPPARDMAPT
SCHEMBL5380963 0.90 FFAR1 (0.54) FFAR1PPARAPPARGPPARDMAPT
SCHEMBL7547493 0.88 PPARA (0.54) FFAR1PPARAPPARGPPARD
SCHEMBL5376721 0.88 FFAR1 (0.46) FFAR1PPARAPPARGPPARDMAPT
SCHEMBL5379449 0.86 FFAR1 (0.51) 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