SCHEMBL6506183

SCHEMBL6506183

Cc1ccc(-c2nc(C(=O)NCc3cc(CC(OC(C)C)C(=O)O)ccc3-c3cc(C)cs3)c(C)s2)cc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.39
PPARD Q03181 10/20 0.39
PPARG P37231 10/20 0.39
MAOB P27338 1/20 0.33
KIT P10721 1/20 0.32
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL6498868 0.91 PPARA (0.40) PPARAPPARDPPARGMAOB
SCHEMBL6502616 0.90 PPARG (0.40) PPARAPPARDPPARGKDM4E
SCHEMBL6504694 0.88 PPARA (0.38) PPARAPPARDPPARGMAOB
SCHEMBL6498964 0.88 PPARA (0.39) PPARAPPARDPPARGMAOB
SCHEMBL6495514 0.85 PPARA (0.40) PPARAPPARDPPARGMAOB
SCHEMBL6505714 0.85 NPC1 (0.41) PPARAPPARDPPARGKDM4E
SCHEMBL7676301 0.85 PPARG (0.43) PPARAPPARDPPARG
SCHEMBL6504631 0.83 PPARG (0.44) PPARAPPARDPPARG
SCHEMBL6496886 0.83 PPARG (0.41) PPARAPPARDPPARG
SCHEMBL6496860 0.82 PPARG (0.49) PPARAPPARDPPARG

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