SCHEMBL7825286

SCHEMBL7825286

CCOC(Cc1ccc(OCCN(C)c2nc3ccccc3o2)cc1OC)C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.74
PPARA Q07869 2/20 0.74

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
SCHEMBL7826101 0.93 PPARG (0.63) PPARGPPARA
SCHEMBL13588984 0.85 PPARG (1.00) PPARGPPARA
SCHEMBL7822831 0.85 PPARG (1.00) PPARGPPARA
SCHEMBL30377955 0.80 PPARG (0.77) PPARGPPARA
SCHEMBL7816314 0.79 PPARG (0.88) PPARGPPARA
SCHEMBL7826457 0.79 PPARG (0.83) PPARGPPARA
SCHEMBL4865298 0.79 PPARG (0.83) PPARGPPARA
SCHEMBL7824139 0.79 PPARG (0.83) PPARGPPARA
SCHEMBL10211510 0.78 PPARG (0.86) PPARGPPARA
SCHEMBL9267167 0.78 PPARG (0.86) 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-0648212-B1 BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES AS PHARMACEUTICAL SMITHKLINE BEECHAM PLC (GB) 2001-10-24 EP claimed