SCHEMBL5371963

SCHEMBL5371963

Cc1oc(-c2ccccc2)nc1COc1ccc(Cn2cc(C=O)c(-c3ccccc3)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.48
PPARA Q07869 17/20 0.48
FFAR1 O14842 1/20 0.46
KDR P35968 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
SCHEMBL6593852 0.90 PPARG (0.49) PPARGPPARAFFAR1KDR
SCHEMBL6593860 0.90 PPARG (0.49) PPARGPPARAFFAR1KDR
SCHEMBL5381987 0.88 FFAR1 (0.57) PPARGPPARAFFAR1KDR
SCHEMBL7542369 0.87 PPARG (0.48) PPARGPPARAFFAR1KDR
SCHEMBL5372022 0.87 PPARG (0.48) PPARGPPARAFFAR1
SCHEMBL5372026 0.87 PPARG (0.47) PPARGPPARAFFAR1KDR
SCHEMBL5380851 0.86 KDR (0.50) PPARGPPARAFFAR1KDR
SCHEMBL5383028 0.84 PPARG (0.50) PPARGPPARAFFAR1
SCHEMBL5380738 0.84 SMN1; SMN2 (0.49) PPARGPPARAFFAR1
SCHEMBL5392056 0.84 FFAR1 (0.58) PPARGPPARAFFAR1

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