SCHEMBL7547490

SCHEMBL7547490

CCC(CC)(c1cn(Cc2ccc(OCc3nc(-c4ccccc4)oc3C)cc2)nc1-c1cccs1)C(C(=O)O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.52
PPARG P37231 17/20 0.48
FFAR1 O14842 1/20 0.47
PPARD Q03181 4/20 0.43

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
SCHEMBL5379449 0.88 FFAR1 (0.51) PPARAPPARGFFAR1PPARD
SCHEMBL7488571 0.87 PPARA (0.48) PPARAPPARGFFAR1PPARD
SCHEMBL7546654 0.86 PPARA (0.47) PPARAPPARGFFAR1
SCHEMBL7488575 0.85 FFAR1 (0.47) PPARAPPARGFFAR1PPARD
SCHEMBL5380963 0.85 FFAR1 (0.54) PPARAPPARGFFAR1PPARD
SCHEMBL5379443 0.85 PPARA (0.55) PPARAPPARGFFAR1PPARD
SCHEMBL7540590 0.84 RAB9A (0.43) PPARAPPARGFFAR1
SCHEMBL7547501 0.84 PPARA (0.49) PPARAPPARGFFAR1PPARD
SCHEMBL5380800 0.83 PPARA (0.53) PPARAPPARGFFAR1PPARD
SCHEMBL5378969 0.83 FFAR1 (0.54) PPARAPPARGFFAR1PPARD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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