SCHEMBL5760036

SCHEMBL5760036

CCCc1cc(Oc2ccc(Cl)cc2)ccc1OCCCOc1ccc(C2(C)SC(=O)NC2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.59
PPARA Q07869 3/20 0.49
PPARD Q03181 2/20 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
SCHEMBL5758758 0.92 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL5756704 0.92 PPARG (0.66) PPARGPPARAPPARD
SCHEMBL5760774 0.90 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL5760773 0.90 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL5759781 0.90 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL5756584 0.90 PPARG (0.63) PPARGPPARAPPARD
SCHEMBL5760221 0.89 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL5760653 0.88 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL5758631 0.87 PPARG (0.60) PPARGPPARAPPARD
SCHEMBL5755218 0.87 PPARG (0.56) PPARGPPARAPPARD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1194146-B1 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES MERCK & CO INC (US) 2006-07-19 EP claimed
US-6399640-B1 ANTIDIABETIC AGENTS; ANTICHOLESTEROL AGENTS MERCK & CO., INC. 2002-06-04 US claimed