Sugi Predict

Sugi Predict / Compounds / SCHEMBL7464720

SCHEMBL7464720

SCHEMBL7464720

CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc(C2(C)NC(=O)SC2=O)cc1.CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc(C2(F)NC(=O)SC2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 20/20 0.55
▸ PPARA Q07869 3/20 0.46
▸ PPARD Q03181 1/20 0.46

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
SCHEMBL5758539 0.95 PPARG (0.60) PPARGPPARAPPARD
SCHEMBL7466146 0.94 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL5759788 0.94 PPARG (0.61) PPARGPPARAPPARD
SCHEMBL7470392 0.93 PPARG (0.57) PPARGPPARAPPARD
SCHEMBL5758187 0.89 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL5761651 0.89 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL5760312 0.89 PPARG (0.60) PPARGPPARAPPARD
SCHEMBL7462061 0.88 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL5760449 0.88 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL5759929 0.88 PPARG (0.61) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1194146-A4 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES MERCK & CO INC (US) 2002-07-31 — — EP 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