SCHEMBL4028587

SCHEMBL4028587

CCC(C)OC(Cc1ccc(OCc2nc(-c3ccc(C)o3)oc2C)cc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.55
PPARG P37231 18/20 0.55
PPARD Q03181 5/20 0.48
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
SCHEMBL4026027 0.88 PPARA (0.70) PPARAPPARGPPARDFFAR1
SCHEMBL4032975 0.88 PPARA (0.56) PPARAPPARGPPARDFFAR1
SCHEMBL4029552 0.85 PPARG (0.68) PPARAPPARGPPARDFFAR1
SCHEMBL4025593 0.85 PPARG (0.62) PPARAPPARGPPARDFFAR1
SCHEMBL4027730 0.84 PPARG (0.56) PPARAPPARGPPARDFFAR1
SCHEMBL4032672 0.83 PPARA (0.79) PPARAPPARGPPARDFFAR1
SCHEMBL4032031 0.83 PPARA (0.59) PPARAPPARGPPARDFFAR1
SCHEMBL4028741 0.83 PPARG (0.79) PPARAPPARGPPARDFFAR1
SCHEMBL4032215 0.82 PPARG (0.57) PPARAPPARGPPARDFFAR1
SCHEMBL4034968 0.82 PPARG (0.63) PPARAPPARGPPARDFFAR1

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