SCHEMBL3374173

SCHEMBL3374173

CCOC(=O)C(Cc1ccc(OCCc2nc(-c3ccc(C(C)C)cc3)sc2C)c(C)c1)OCC

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.46
PPARA Q07869 15/20 0.46
PPARD Q03181 3/20 0.41
RARA P10276 1/20 0.36
RARB P10826 1/20 0.36
RARG P13631 1/20 0.36

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
SCHEMBL3373023 0.93 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL3371005 0.91 PPARG (0.45) PPARGPPARAPPARD
SCHEMBL3369718 0.90 PPARG (0.47) PPARGPPARAPPARDRARARARB
SCHEMBL3372687 0.90 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL3374331 0.89 PPARG (0.41) PPARGPPARAPPARD
SCHEMBL3374455 0.86 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL3370559 0.84 PPARG (0.47) PPARGPPARAPPARD
SCHEMBL3370565 0.83 PPARG (0.49) PPARGPPARAPPARDRARARARB
SCHEMBL3373906 0.83 MAPT (0.43) PPARGPPARAPPARD
SCHEMBL3371570 0.82 PPARG (0.50) 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-1537091-B1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMMA AGONISTS HOFFMANN LA ROCHE (CH) 2010-10-06 EP disclosed
EP-1537091-A1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMMA AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2005-06-08 EP disclosed
US-6809110-B2 NONINSULIN DEPENDENT DIABETES; SUCH AS 2-ETHOXY-3-(4-(2-(5-METHYL-2-PHENYL-THIAZOL-4-YL)-ETHOXY)-BENZO(B)THIOPHEN-7-YL)-PROPIONIC ACID HOFFMANN-LA ROCHE INC. 2004-10-26 US disclosed
WO-2004020420-A1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMA AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2004-03-11 WO disclosed