SCHEMBL4029562

SCHEMBL4029562

CCO[C@@](CC)(Cc1ccc(OCc2nc(-c3ccc(C)s3)oc2C)cc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.57
PPARA Q07869 17/20 0.57
PPARD Q03181 7/20 0.51
FFAR1 O14842 1/20 0.48

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
SCHEMBL4034249 0.92 PPARG (0.65) PPARGPPARAPPARD
SCHEMBL4032709 0.91 PPARA (0.67) PPARGPPARAPPARDFFAR1
SCHEMBL4032678 0.87 PPARA (0.66) PPARGPPARAPPARDFFAR1
SCHEMBL4030690 0.86 PPARA (0.53) PPARGPPARAPPARDFFAR1
SCHEMBL4025602 0.84 PPARA (0.59) PPARGPPARAPPARDFFAR1
SCHEMBL4028595 0.84 PPARA (0.52) PPARGPPARAPPARDFFAR1
SCHEMBL4032035 0.84 PPARA (0.50) PPARGPPARAPPARDFFAR1
SCHEMBL4028748 0.84 PPARA (0.66) PPARGPPARAPPARDFFAR1
SCHEMBL4027736 0.83 PPARA (0.56) PPARGPPARAPPARDFFAR1
SCHEMBL4030508 0.83 PPARA (0.68) 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