SCHEMBL5758169

SCHEMBL5758169

CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc(C2(F)SC(=O)NC2=O)cc1CCC

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.59
PPARD Q03181 2/20 0.51
PPARA Q07869 1/20 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
SCHEMBL5756755 0.95 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5756920 0.94 PPARG (0.55) PPARGPPARDPPARA
SCHEMBL5759494 0.94 PPARG (0.62) PPARGPPARDPPARA
SCHEMBL5758533 0.94 PPARG (0.61) PPARGPPARDPPARA
SCHEMBL5758285 0.93 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5758546 0.92 PPARG (0.53) PPARGPPARDPPARA
SCHEMBL5759923 0.92 PPARG (0.62) PPARGPPARDPPARA
SCHEMBL5756934 0.91 PPARG (0.54) PPARGPPARDPPARA
SCHEMBL5758631 0.90 PPARG (0.60) PPARGPPARDPPARA
SCHEMBL7464715 0.89 PPARG (0.56) PPARGPPARDPPARA

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