SCHEMBL4028741

SCHEMBL4028741

CCC(C)OC(Cc1ccc(OCc2nc(-c3ccsc3)oc2C)cc1)C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.79
PPARA Q07869 17/20 0.79
PPARD Q03181 3/20 0.50
FFAR1 O14842 1/20 0.50

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
SCHEMBL4031951 0.92 PPARG (0.80) PPARGPPARAPPARD
SCHEMBL4025593 0.89 PPARG (0.62) PPARGPPARAPPARDFFAR1
SCHEMBL4025913 0.89 PPARA (1.00) PPARGPPARAPPARDFFAR1
SCHEMBL4029552 0.85 PPARG (0.68) PPARGPPARAPPARDFFAR1
SCHEMBL4032672 0.84 PPARA (0.79) PPARGPPARAPPARDFFAR1
SCHEMBL4032031 0.84 PPARA (0.59) PPARGPPARAPPARDFFAR1
SCHEMBL4032215 0.84 PPARG (0.57) PPARGPPARAPPARDFFAR1
SCHEMBL4028587 0.83 PPARA (0.55) PPARGPPARAPPARDFFAR1
SCHEMBL4032703 0.83 PPARG (0.80) PPARGPPARAPPARDFFAR1
SCHEMBL4032693 0.82 PPARG (0.63) PPARGPPARAPPARDFFAR1

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