SCHEMBL5668337

SCHEMBL5668337

Cc1oc(-c2cccc(Br)c2)nc1CN(Cc1ccc(OC(C)(C)C(=O)O)cc1)C(C)c1nc2ccccc2[nH]1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.68
PPARG P37231 18/20 0.68
PPARD Q03181 1/20 0.42

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
SCHEMBL5484463 0.78 PPARA (0.87) PPARAPPARG
SCHEMBL5481550 0.78 PPARA (0.89) PPARAPPARG
SCHEMBL5668334 0.77 PPARA (0.80) PPARAPPARG
SCHEMBL5472031 0.76 PPARA (0.83) PPARAPPARG
SCHEMBL5484849 0.76 PPARA (0.82) PPARAPPARG
SCHEMBL14414950 0.76 PPARA (0.82) PPARAPPARG
Hydrochloric Acid SCHEMBL5476612 0.76 PPARA (0.82) PPARAPPARG
SCHEMBL5669226 0.76 PPARG (0.51) PPARAPPARGPPARD
Hydrochloric Acid SCHEMBL5482682 0.75 PPARA (0.81) PPARAPPARG
SCHEMBL5483349 0.75 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-1731513-A1 PHENOXYACETIC ACID DERIVATIVE AND MEDICINE CONTAINING THE SAME DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-13 EP disclosed