SCHEMBL6575581

SCHEMBL6575581

CCOC(=O)C(Cc1ccc(OS(=O)(=O)C(F)(F)F)cc1)OC

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.45
PPARA Q07869 13/20 0.44
CXCR2 P25025 2/20 0.41
PPARD Q03181 5/20 0.41
CXCR1 P25024 1/20 0.41
EPHX2 P34913 1/20 0.39
LDHA P00338 1/20 0.39
STS P08842 1/20 0.38

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
SCHEMBL5375683 1.00 PPARG (0.45) PPARGPPARACXCR2PPARDCXCR1
SCHEMBL5365330 0.90 PPARG (0.53) PPARGPPARACXCR2PPARD
SCHEMBL5409308 0.82 PPARA (0.63) PPARGPPARAPPARD
SCHEMBL5387063 0.81 PPARA (0.40) PPARGPPARAPPARDEPHX2LDHA
SCHEMBL2855147 0.79 TACR1 (0.48) PPARGPPARACXCR2EPHX2
SCHEMBL2855146 0.79 TACR1 (0.48) PPARGPPARACXCR2EPHX2
SCHEMBL5360137 0.78 PPARA (0.55) PPARGPPARAPPARD
SCHEMBL5361601 0.77 PPARA (0.50) PPARGPPARAPPARD
SCHEMBL14392329 0.77 MMP8 (0.56) PPARGPPARAPPARDEPHX2
SCHEMBL9119394 0.77 MMP8 (0.56) PPARGPPARAPPARDEPHX2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 WO disclosed