SCHEMBL5758380

SCHEMBL5758380

CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc(C2(C)NC(=O)SC2=O)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.54
PPARA Q07869 3/20 0.47
PPARD Q03181 1/20 0.47

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
SCHEMBL5757862 0.98 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL5759788 0.92 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL5760312 0.92 PPARG (0.60) PPARGPPARAPPARD
SCHEMBL5758554 0.90 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL5760449 0.90 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL5759966 0.89 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL5759278 0.89 PPARG (0.63) PPARGPPARAPPARD
SCHEMBL5756923 0.88 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL5759421 0.88 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL5761030 0.88 PPARG (0.63) 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 7 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
EP-1194146-B1 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES MERCK & CO INC (US) 2006-07-19 EP disclosed
EP-1194146-A4 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES MERCK & CO INC (US) 2002-07-31 EP disclosed
US-6399640-B1 ANTIDIABETIC AGENTS; ANTICHOLESTEROL AGENTS MERCK & CO., INC. 2002-06-04 US disclosed
EP-1194146-A1 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES Merck & Co., Inc. (US) 2002-04-10 EP disclosed
WO-2000078312-A1 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES MERCK & CO., INC. (US) 2000-12-28 WO disclosed