SCHEMBL6503040

SCHEMBL6503040

CCON=C(C)C(Cc1ccc(OCCSc2ccccc2)cc1)C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.51
PPARA Q07869 17/20 0.51
PPARD Q03181 4/20 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
SCHEMBL6503037 1.00 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL6508944 0.92 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL6508939 0.92 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL6510502 0.82 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL6510499 0.82 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL6506592 0.78 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL6506595 0.78 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL6507933 0.77 ESR1 (0.50) PPARGPPARAPPARD
SCHEMBL6510040 0.77 ESR1 (0.50) PPARGPPARAPPARD
SCHEMBL6507816 0.74 PPARG (0.87) PPARGPPARA

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
WO-2005040127-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2005-05-06 WO disclosed