SCHEMBL7723286

SCHEMBL7723286

Cc1oc(-c2ccccc2)nc1CCC(=O)c1ccc(CC2NC(=O)SC2=O)c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.42
PPARA Q07869 16/20 0.42
PPARD Q03181 5/20 0.41
KDM4E B2RXH2 1/20 0.41
FFAR1 O14842 1/20 0.37

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
SCHEMBL7727765 0.91 KDM4E (0.47) PPARGPPARAPPARDKDM4E
SCHEMBL7722471 0.84 PPARG (0.41) PPARGPPARAPPARDKDM4E
SCHEMBL7719068 0.84 PPARG (0.43) PPARGPPARAPPARDKDM4E
SCHEMBL7727703 0.84 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL1220163 0.82 PPARG (0.45) PPARGPPARAPPARDKDM4EFFAR1
SCHEMBL7723502 0.80 PPARG (0.47) PPARGPPARAPPARDFFAR1
SCHEMBL7724111 0.79 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL7722509 0.79 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL8877627 0.78 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL7727745 0.77 PPARG (0.51) 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-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
US-5599826-A ANTIDIABETIC AGENT BOEHRINGER MANNHEIM GMBH (DE) 1997-02-04 US disclosed