SCHEMBL7722486

SCHEMBL7722486

Cc1oc(-c2ccccc2)nc1CCOc1ccoc2ccc(CC3SC(=O)NC3=O)c1-2

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.45
PPARA Q07869 18/20 0.45
PPARD Q03181 5/20 0.43

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
SCHEMBL7722480 0.87 PPARG (0.45) PPARGPPARAPPARD
SCHEMBL7722476 0.85 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL7727718 0.85 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL7722481 0.85 PPARG (0.47) PPARGPPARAPPARD
SCHEMBL3731430 0.84 PPARG (0.59) PPARGPPARAPPARD
Edaglitazone SCHEMBL2642937 0.81 PPARG (0.64) PPARGPPARAPPARD
Edaglitazone SCHEMBL29365673 0.81 PPARG (0.64) PPARGPPARAPPARD
SCHEMBL7722504 0.81 PPARG (0.49) PPARGPPARAPPARD
Edaglitazone SCHEMBL22607966 0.81 PPARG (0.64) PPARGPPARAPPARD
SCHEMBL5743619 0.81 PPARG (0.48) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0700397-B1 NEW THIAZOLIDINDIONES AND DRUGS CONTAINING THEM ROCHE DIAGNOSTICS GMBH (DE) 2002-09-04 EP claimed
US-5599826-A ANTIDIABETIC AGENT BOEHRINGER MANNHEIM GMBH (DE) 1997-02-04 US claimed
EP-0700397-B1 NEW THIAZOLIDINDIONES AND DRUGS CONTAINING THEM ROCHE DIAGNOSTICS GMBH (DE) 2002-09-04 EP disclosed
US-5599826-A ANTIDIABETIC AGENT BOEHRINGER MANNHEIM GMBH (DE) 1997-02-04 US disclosed
EP-0700397-A1 NEW THIAZOLIDINDIONES AND DRUGS CONTAINING THEM Roche Diagnostics GmbH (DE) 1996-03-13 EP disclosed
WO-1994027995-A1 NEW THIAZOLIDINDIONES AND DRUGS CONTAINING THEM BOEHRINGER MANNHEIM GMBH (DE) 1994-12-08 WO disclosed