SCHEMBL5758533

SCHEMBL5758533

CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc(C2(F)SC(=O)NC2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.61
PPARA Q07869 5/20 0.51
PPARD Q03181 2/20 0.51

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
SCHEMBL7464715 0.96 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL5756934 0.94 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL5758169 0.94 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL5759923 0.93 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL5754835 0.93 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL5758406 0.93 PPARG (0.55) PPARGPPARAPPARD
SCHEMBL5758546 0.91 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL5759494 0.91 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL5757625 0.91 PPARG (0.65) PPARGPPARAPPARD
SCHEMBL5754729 0.91 PPARG (0.54) 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 4 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
US-6399640-B1 ANTIDIABETIC AGENTS; ANTICHOLESTEROL AGENTS MERCK & CO., INC. 2002-06-04 US disclosed