SCHEMBL9696344

SCHEMBL9696344

CC(C)(C)c1cc(OC(CCCCCc2ccc(Cl)cc2)C(=O)O)cc(C(C)(C)C)c1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.64
PPARG P37231 18/20 0.64
PTGES O14684 1/20 0.45
ALOX5 P09917 1/20 0.45

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
SCHEMBL9614193 0.90 PPARA (0.73) PPARAPPARG
SCHEMBL9614218 0.90 PPARA (0.73) PPARAPPARG
SCHEMBL9697420 0.87 PPARA (0.61) PPARAPPARGPTGESALOX5
SCHEMBL9696483 0.85 PPARA (0.81) PPARAPPARG
SCHEMBL9696467 0.84 PPARA (0.89) PPARAPPARG
SCHEMBL9696946 0.84 PPARA (0.74) PPARAPPARG
SCHEMBL9696319 0.83 PPARG (0.61) PPARAPPARGPTGESALOX5
SCHEMBL9696493 0.83 PPARA (0.65) PPARAPPARGPTGESALOX5
SCHEMBL9696927 0.82 PPARG (0.61) PPARAPPARG
SCHEMBL10420222 0.82 PPARA (0.80) PPARAPPARG

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
EP-0507238-A1 Optically active carboxylic acids and medicinal preparations containing them Roche Diagnostics GmbH (DE) 1992-10-07 EP disclosed