SCHEMBL6969712

SCHEMBL6969712

Cc1oc(-c2ccccc2)nc1COc1ccccc1CCCC1NC(=O)SC1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.43
KDR P35968 1/20 0.40
PPARG P37231 14/20 0.40
PPARA Q07869 13/20 0.40
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
PPARD Q03181 2/20 0.38
MAPT P10636 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
SCHEMBL5080606 0.86 FFAR1 (0.59) FFAR1KDRPPARGPPARAPPARD
SCHEMBL4727181 0.85 PPARG (0.54) FFAR1KDRPPARGPPARAPPARD
SCHEMBL5083107 0.85 PPARG (0.43) FFAR1KDRPPARGPPARATP53
SCHEMBL6052232 0.83 PPARG (0.47) FFAR1PPARGPPARA
SCHEMBL6973894 0.83 KDR (0.58) FFAR1KDRPPARGPPARA
SCHEMBL8341159 0.83 FFAR1 (0.52) FFAR1KDRPPARGPPARA
SCHEMBL8341311 0.83 PPARG (0.42) FFAR1KDRPPARGPPARAPPARD
SCHEMBL6969705 0.82 FFAR1 (0.45) FFAR1KDRPPARGPPARAKDM4E
SCHEMBL6968339 0.82 FFAR1 (0.61) FFAR1KDRPPARGPPARAPPARD
SCHEMBL6966833 0.81 PPARG (0.48) FFAR1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783496-B9 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-09-03 EP disclosed
EP-0783496-B1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-26 EP disclosed
US-5965589-A AN ACTIVE MATERIAL HAVING HYPOGLYCEMIC ACTIVITY AND BLOOD LIPID LOWERING ACTIVITY, FOR USE AS AN ANTIDIABETIC AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-12 US disclosed
EP-0783496-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-07-16 EP disclosed
WO-1996005186-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-22 WO disclosed