SCHEMBL6496110

SCHEMBL6496110

COc1ccc(CC(OC(C)C)C(=O)O)cc1CNC(=O)C(C)=Cc1cccc(Cl)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.42
PPARD Q03181 13/20 0.42
PPARG P37231 11/20 0.42
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.38
MMP1 P03956 1/20 0.37

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
SCHEMBL6496109 1.00 PPARA (0.42) PPARAPPARDPPARGLMNAHPGD
SCHEMBL6495628 0.93 PPARA (0.45) PPARAPPARDPPARGKMT2AMMP1
SCHEMBL6495621 0.93 PPARA (0.45) PPARAPPARDPPARGKMT2AMMP1
SCHEMBL6504226 0.87 PPARA (0.44) PPARAPPARDPPARGLMNAMMP1
SCHEMBL6504220 0.87 PPARA (0.44) PPARAPPARDPPARGLMNAMMP1
SCHEMBL6503992 0.87 PPARA (0.46) PPARAPPARDPPARGLMNAKMT2A
SCHEMBL6503985 0.87 PPARA (0.46) PPARAPPARDPPARGLMNAKMT2A
SCHEMBL6506175 0.87 MMP1 (0.44) PPARAPPARDPPARGMMP1
SCHEMBL6502801 0.87 PPARA (0.46) PPARAPPARDPPARGHPGDKMT2A
SCHEMBL6502803 0.87 PPARA (0.46) PPARAPPARDPPARGHPGDKMT2A

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