SCHEMBL6502884

SCHEMBL6502884

Cc1sc(-c2cccs2)nc1C(=O)NCc1cc(CC(OC(C)C)C(=O)O)ccc1OC(C)C

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.43
KDM4E B2RXH2 4/20 0.38
GAA P10253 1/20 0.38
PPARA Q07869 10/20 0.37
PPARD Q03181 8/20 0.37
ALDH1A1 P00352 1/20 0.37
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 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
SCHEMBL6498808 0.94 PPARA (0.44) PPARGKDM4EPPARAPPARDNPC1
SCHEMBL6503260 0.92 PPARG (0.47) PPARGKDM4EGAAPPARAPPARD
SCHEMBL6505646 0.91 PPARG (0.55) PPARGPPARAPPARD
SCHEMBL6504835 0.89 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL6507195 0.89 PPARG (0.40) PPARGKDM4EGAAPPARAPPARD
SCHEMBL7676301 0.87 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL6504638 0.85 PPARA (0.44) PPARGKDM4EPPARAPPARD
SCHEMBL6496502 0.85 PPARA (0.39) PPARGPPARAPPARDALDH1A1
SCHEMBL6502616 0.84 PPARG (0.40) PPARGKDM4EPPARAPPARDNPC1
SCHEMBL6527212 0.84 PPARA (0.45) PPARGPPARAPPARD

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