SCHEMBL6504226

SCHEMBL6504226

COc1ccc(CC(OC(C)C)C(=O)O)cc1CNC(=O)C(C)=Cc1ccc(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.44
PPARD Q03181 12/20 0.44
PPARG P37231 9/20 0.44
MMP1 P03956 1/20 0.40
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 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
SCHEMBL6504220 1.00 PPARA (0.44) PPARAPPARDPPARGMMP1LMNA
SCHEMBL6495628 0.91 PPARA (0.45) PPARAPPARDPPARGMMP1MAPT
SCHEMBL6495621 0.91 PPARA (0.45) PPARAPPARDPPARGMMP1MAPT
SCHEMBL6501017 0.89 MMP1 (0.48) PPARAPPARDPPARGMMP1LMNA
SCHEMBL6501010 0.89 MMP1 (0.48) PPARAPPARDPPARGMMP1LMNA
SCHEMBL6496110 0.87 PPARA (0.42) PPARAPPARDPPARGMMP1LMNA
SCHEMBL6496109 0.87 PPARA (0.42) PPARAPPARDPPARGMMP1LMNA
SCHEMBL6503176 0.85 PPARA (0.41) PPARAPPARDPPARGMMP1LMNA
SCHEMBL6503180 0.85 PPARA (0.41) PPARAPPARDPPARGMMP1LMNA
SCHEMBL6503992 0.84 PPARA (0.46) PPARAPPARDPPARGMMP1LMNA

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 1 patent. 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