SCHEMBL4034249

SCHEMBL4034249

CCO[C@@](CC)(Cc1ccc(OCCc2nc(-c3ccc(C)s3)oc2C)cc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.65
PPARA Q07869 19/20 0.62
PPARD Q03181 11/20 0.62

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
SCHEMBL4029562 0.92 PPARG (0.57) PPARGPPARAPPARD
SCHEMBL4030508 0.91 PPARA (0.68) PPARGPPARAPPARD
SCHEMBL5114055 0.89 PPARA (0.79) PPARGPPARAPPARD
SCHEMBL5114063 0.89 PPARA (0.79) PPARGPPARAPPARD
SCHEMBL4034280 0.88 PPARA (0.70) PPARGPPARAPPARD
SCHEMBL4026414 0.86 PPARA (0.61) PPARGPPARAPPARD
SCHEMBL4026144 0.86 PPARA (0.82) PPARGPPARAPPARD
SCHEMBL5113150 0.85 PPARA (0.67) PPARGPPARAPPARD
SCHEMBL5113158 0.85 PPARA (0.67) PPARGPPARAPPARD
SCHEMBL4201152 0.84 PPARA (0.66) PPARGPPARAPPARD

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
EP-1569916-B1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD (IN) 2009-01-07 EP claimed