SCHEMBL4451913

SCHEMBL4451913

CCC(C)OC(Cc1ccc(OC(C)(C)C)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.47
PPARG P37231 15/20 0.47
ACACB O00763 2/20 0.46

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
SCHEMBL4460245 0.82 PPARA (0.68) PPARAPPARG
SCHEMBL4460251 0.82 PPARA (0.68) PPARAPPARG
SCHEMBL4468834 0.81 PPARA (0.57) PPARAPPARGACACB
SCHEMBL6732246 0.81 PPARA (0.48) PPARAPPARG
SCHEMBL4462336 0.81 PPARA (0.57) PPARAPPARGACACB
SCHEMBL3963049 0.81 PPARA (0.48) PPARAPPARG
SCHEMBL5365342 0.81 PPARA (0.46) PPARAPPARG
SCHEMBL6396437 0.80 PPARA (0.53) PPARAPPARG
SCHEMBL5365626 0.79 PPARA (0.46) PPARAPPARGACACB
SCHEMBL12040135 0.78 ACACB (0.53) PPARAPPARGACACB

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-20090029429-A1 Process for Producing Optically Active 2-Substituent-Oxy-3-(4-Substituent-Oxyphenyl) Propionic Acid Derivative KANEKA CORPORATION (JP) 2009-01-29 US disclosed