SCHEMBL4034277

SCHEMBL4034277

CCC(C)OOC(=O)CCc1ccc(OCCc2nc(-c3cccs3)oc2C)cc1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.62
PPARA Q07869 15/20 0.62
PPARD Q03181 7/20 0.57

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
SCHEMBL4201144 0.97 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL4032676 0.93 PPARA (0.61) PPARGPPARAPPARD
SCHEMBL4034248 0.88 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL4027762 0.88 PPARG (0.66) PPARGPPARAPPARD
SCHEMBL4032530 0.86 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL4026131 0.86 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL4030505 0.86 PPARG (0.64) PPARGPPARAPPARD
SCHEMBL4032230 0.86 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL4028698 0.86 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL4031954 0.85 PPARG (0.62) 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