SCHEMBL6582598

SCHEMBL6582598

CCOC(=O)C(C)(C)Oc1ccc(CNC(=O)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.63
PPARG P37231 6/20 0.63
PPARD Q03181 5/20 0.63
NPC1 O15118 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.50

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
SCHEMBL6583596 0.93 PPARA (0.64) PPARAPPARGPPARDNPC1ALDH1A1
SCHEMBL6582790 0.91 PPARA (0.76) PPARAPPARGPPARD
SCHEMBL7526072 0.90 PPARA (0.61) PPARAPPARGPPARD
SCHEMBL5185069 0.87 PPARA (0.82) PPARAPPARGPPARD
SCHEMBL6580900 0.83 PPARA (0.77) PPARAPPARGPPARD
SCHEMBL6583337 0.82 PPARA (0.80) PPARAPPARGPPARDGAA
SCHEMBL6584688 0.81 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL7466720 0.81 PPARA (0.73) PPARAPPARGPPARD
SCHEMBL6927188 0.81 PPARA (0.73) PPARAPPARGPPARD
SCHEMBL6582740 0.81 PPARA (0.82) PPARAPPARGPPARDNPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1244642-B1 SUBSTITUTED OXAZOLES AND THIAZOLES DERIVATIVES AS HPPAR ALPHA ACTIVATORS GLAXO GROUP LTD (GB) 2004-04-28 EP claimed
US-6518290-B1 Compounds that activate or otherwise interact with one or more of the PPARs have been implicated in the regulation of triglyceride and cholesterol levels in animal models SMITHKLINE BEECHAM CORPORATION 2003-02-11 US claimed
EP-1244642-B1 SUBSTITUTED OXAZOLES AND THIAZOLES DERIVATIVES AS HPPAR ALPHA ACTIVATORS GLAXO GROUP LTD (GB) 2004-04-28 EP disclosed
US-6518290-B1 Compounds that activate or otherwise interact with one or more of the PPARs have been implicated in the regulation of triglyceride and cholesterol levels in animal models SMITHKLINE BEECHAM CORPORATION 2003-02-11 US disclosed
EP-1244642-A1 SUBSTITUTED OXAZOLES AND THIAZOLES DERIVATIVES AS HPPAR ALPHA ACTIVATORS GLAXO GROUP LIMITED (GB) 2002-10-02 EP disclosed
WO-2001040207-A1 SUBSTITUTED OXAZOLES AND THIAZOLES DERIVATIVES AS HPPAR ALPHA ACTIVATORS GLAXO GROUP LIMITED (GB) 2001-06-07 WO disclosed