SCHEMBL6496499

SCHEMBL6496499

CCOC(=O)C(Cc1ccc(OS(=O)(=O)C(F)(F)F)c(CNC(=O)OC(C)(C)C)c1)OC(C)C

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.39
PPARD Q03181 15/20 0.38
PPARA Q07869 14/20 0.38
EPHX2 P34913 2/20 0.35

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
SCHEMBL6503438 0.86 PPARG (0.44) PPARGPPARDPPARA
SCHEMBL6496923 0.86 PPARA (0.45) PPARGPPARDPPARA
SCHEMBL6497644 0.86 ALDH1A1 (0.43) PPARGPPARDPPARAEPHX2
SCHEMBL6507710 0.84 PPARG (0.45) PPARGPPARDPPARA
SCHEMBL5549723 0.82 HDAC1 (0.39) PPARGEPHX2
SCHEMBL6498144 0.81 NPY1R (0.37) PPARGPPARDPPARAEPHX2
SCHEMBL4337044 0.79 MAPT (0.46) PPARGEPHX2
SCHEMBL6495642 0.78 PPARA (0.50) PPARGPPARDPPARA
SCHEMBL4327276 0.77 GLS (0.44)
SCHEMBL5549065 0.77 AAK1 (0.34) PPARGEPHX2

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
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed