SCHEMBL7542369

SCHEMBL7542369

COc1cn(Cc2ccc(OCc3nc(-c4ccccc4)oc3C)nc2)cc1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.48
PPARA Q07869 17/20 0.48
KDR P35968 1/20 0.46
FFAR1 O14842 1/20 0.45

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
SCHEMBL5380851 0.88 KDR (0.50) PPARGPPARAKDRFFAR1
SCHEMBL5371963 0.87 PPARG (0.48) PPARGPPARAKDRFFAR1
SCHEMBL5383028 0.86 PPARG (0.50) PPARGPPARAFFAR1
SCHEMBL6593852 0.84 PPARG (0.49) PPARGPPARAKDRFFAR1
SCHEMBL6593860 0.84 PPARG (0.49) PPARGPPARAKDRFFAR1
SCHEMBL5392056 0.83 FFAR1 (0.58) PPARGPPARAFFAR1
SCHEMBL5372026 0.81 PPARG (0.47) PPARGPPARAKDRFFAR1
SCHEMBL5372022 0.81 PPARG (0.48) PPARGPPARAFFAR1
SCHEMBL5385634 0.81 PPARG (0.49) PPARGPPARAFFAR1
SCHEMBL4034034 0.81 KDR (0.65) PPARGPPARAKDRFFAR1

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