SCHEMBL4796629

SCHEMBL4796629

Cc1oc(-c2ccccc2)nc1CON=CCCc1ccc(OCC(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.64
PPARA Q07869 17/20 0.64
FFAR1 O14842 1/20 0.63
PPARD Q03181 3/20 0.52

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
SCHEMBL4728902 0.94 PPARA (0.55) PPARGPPARAFFAR1PPARD
SCHEMBL15543187 0.87 FFAR1 (0.52) PPARGPPARAFFAR1
SCHEMBL12476895 0.85 FFAR1 (0.50) PPARGPPARAFFAR1
SCHEMBL4729706 0.84 PPARG (0.45) PPARGPPARAFFAR1PPARD
SCHEMBL4728540 0.84 PPARG (0.56) PPARGPPARAFFAR1PPARD
SCHEMBL4726310 0.80 PPARG (0.67) PPARGPPARAFFAR1PPARD
SCHEMBL5110945 0.79 PPARG (1.00) PPARGPPARAFFAR1PPARD
SCHEMBL7652265 0.78 PPARG (0.74) PPARGPPARAFFAR1PPARD
SCHEMBL5105247 0.78 PPARG (0.70) PPARGPPARAFFAR1
SCHEMBL4728610 0.78 PPARA (0.49) PPARGPPARAFFAR1PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008035359-A2 OXIMINOPHENOXYALKANOIC ACID AND PHENYLALKANOIC ACID DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2008-03-27 WO disclosed