SCHEMBL5669226

SCHEMBL5669226

Cc1oc(Oc2cccc(Br)c2)nc1CN(Cc1ccc(OC(C)(C)C(=O)O)cc1)C(C)c1ncc[nH]1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.51
PPARA Q07869 17/20 0.51
PPARD Q03181 1/20 0.34

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
SCHEMBL5484428 0.92 PPARA (0.43) PPARGPPARA
SCHEMBL5669222 0.78 PPARA (0.60) PPARGPPARA
SCHEMBL5668337 0.76 PPARA (0.68) PPARGPPARAPPARD
SCHEMBL5484427 0.70 PPARA (0.51) PPARGPPARA
SCHEMBL5481550 0.67 PPARA (0.89) PPARGPPARA
SCHEMBL5484463 0.66 PPARA (0.87) PPARGPPARA
SCHEMBL5669880 0.66 PPARA (0.55) PPARGPPARA
SCHEMBL5483538 0.66 PPARA (0.85) PPARGPPARA
Hydrochloric Acid SCHEMBL5669569 0.66 PPARA (0.84) PPARGPPARA
SCHEMBL5483349 0.65 PPARA (0.80) PPARGPPARA

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