SCHEMBL6969220

SCHEMBL6969220

COc1cc(CCCC2SC(=O)NC2=O)ccc1OCc1coc(-c2ccccc2)n1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.44
PPARG P37231 6/20 0.44
FFAR1 O14842 4/20 0.43
PPARA Q07869 6/20 0.40
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
APP P05067 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
S1PR4 O95977 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR5 Q9H228 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL6973190 0.88 PTPN1 (0.43) PTPN1PPARGMTNR1AMTNR1BAPP
SCHEMBL6969292 0.86 PTPN1 (0.42) PTPN1PPARGFFAR1MTNR1AMTNR1B
SCHEMBL6975086 0.86 PTPN1 (0.42) PTPN1PPARGFFAR1MTNR1AMTNR1B
SCHEMBL6967418 0.85 ALDH1A1 (0.47) PTPN1PPARGFFAR1PPARAMTNR1A
SCHEMBL4727180 0.85 PPARG (0.57) PTPN1PPARGFFAR1PPARALMNA
SCHEMBL6585583 0.84 PPARG (0.61) PPARGFFAR1PPARAMTNR1AMTNR1B
SCHEMBL6969226 0.84 FFAR1 (0.41) PPARGFFAR1PPARAMTNR1AMTNR1B
SCHEMBL6585594 0.83 PPARG (0.42) PPARGFFAR1PPARAMTNR1AMTNR1B
SCHEMBL8801421 0.81 PPARG (0.50) PPARGPPARA
SCHEMBL6973328 0.81 PTPN1 (0.45) PTPN1PPARGFFAR1PPARAMTNR1A

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