SCHEMBL6498076

SCHEMBL6498076

CCCOC(Cc1ccc(OC)c(CNC(=O)c2ccc(OC3CCCC3)cc2Cl)c1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.47
PPARD Q03181 16/20 0.47
PPARG P37231 14/20 0.47
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43

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
SCHEMBL6506584 0.89 PPARA (0.46) PPARAPPARDPPARGPDE4APDE4B
SCHEMBL6505315 0.86 PPARG (0.46) PPARAPPARDPPARG
SCHEMBL6495528 0.86 PPARA (0.52) PPARAPPARDPPARG
SCHEMBL6503457 0.84 PDE4A (0.42) PPARAPPARDPPARGPDE4APDE4B
SCHEMBL6502930 0.83 PPARG (0.42) PPARAPPARDPPARG
SCHEMBL6503062 0.83 PDE4A (0.40) PPARAPPARDPPARGPDE4APDE4B
SCHEMBL5549019 0.81 PPARA (0.51) PPARAPPARDPPARG
SCHEMBL6507629 0.81 PPARA (0.49) PPARAPPARDPPARG
SCHEMBL6496320 0.80 PDE4A (0.42) PPARAPPARDPPARGPDE4APDE4B
SCHEMBL6505998 0.80 PPARA (0.58) 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