SCHEMBL8009934

SCHEMBL8009934

COCCO[C@H](C(=O)N1C(=O)OCC1Cc1ccccc1)[C@@H](O)c1ccc(OCCN(C)c2nc3ccccc3o2)cc1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.49
PPARA Q07869 1/20 0.49

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
SCHEMBL7998098 0.91 PPARG (0.56) PPARGPPARA
SCHEMBL8013752 0.88 PPARG (0.60) PPARGPPARA
SCHEMBL8010106 0.80 PPARG (0.70) PPARGPPARA
SCHEMBL6727325 0.77 FAAH (0.44) PPARA
SCHEMBL4865298 0.72 PPARG (0.83) PPARGPPARA
SCHEMBL7826457 0.72 PPARG (0.83) PPARGPPARA
SCHEMBL4327346 0.71 PPARA (0.42) PPARA
SCHEMBL5805154 0.70 PPARG (0.74) PPARGPPARA
SCHEMBL9220821 0.70 PPARG (0.62) PPARGPPARA
SCHEMBL7825493 0.70 PPARG (0.73) 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
US-6166049-A Use of an antagonist of PPARα and PPARγ for the treatment of syndrome X SMITHKLINE BEECHAM P.L.C. (GB) 2000-12-26 US disclosed