SCHEMBL6973190

SCHEMBL6973190

COc1cc(CCCC2SC(=O)NC2=O)ccc1OCc1coc(CCc2ccccc2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.43
PPARG P37231 1/20 0.42
MTNR1A P48039 2/20 0.41
MTNR1B P49286 2/20 0.41
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
APP P05067 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RAF1 P04049 2/20 0.38
MAP2K1 Q02750 2/20 0.38
ADRB2 P07550 3/20 0.37
MAPT P10636 2/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
ABCB1 P08183 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
DRD2 P14416 2/20 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
SCHEMBL6969220 0.88 PTPN1 (0.44) PTPN1PPARGMTNR1AMTNR1BALDH1A1
SCHEMBL6969292 0.85 PTPN1 (0.42) PTPN1PPARGMTNR1AMTNR1BALDH1A1
SCHEMBL6975086 0.85 PTPN1 (0.42) PTPN1PPARGMTNR1AMTNR1BALDH1A1
SCHEMBL6587576 0.85 PPARG (0.58) PPARGMTNR1AMTNR1BALDH1A1APP
SCHEMBL6960498 0.85 HDAC1 (0.45) PTPN1PPARGMTNR1AMTNR1BALDH1A1
SCHEMBL8340545 0.84 MTNR1A (0.41) PPARGMTNR1AMTNR1BALDH1A1APP
SCHEMBL6587579 0.83 PPARG (0.40) PPARGMTNR1AMTNR1BALDH1A1APP
SCHEMBL6967418 0.81 ALDH1A1 (0.47) PTPN1PPARGMTNR1AMTNR1BALDH1A1
SCHEMBL8800145 0.80 MTNR1A (0.37) PPARGMTNR1AMTNR1BAPPMEN1
SCHEMBL8888759 0.78 PTPN1 (0.42) PTPN1PPARGMTNR1AMTNR1BALDH1A1

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-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