SCHEMBL2867930

SCHEMBL2867930

CCCCCCc1c(O)ccc(S)c1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCGR P47871 2/20 0.47
CNR2 P34972 1/20 0.43
TYR P14679 1/20 0.42
DHFR P00374 1/20 0.42
MGLL Q99685 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
BID P55957 3/20 0.38
MCL1 Q07820 3/20 0.38
KAT8 Q9H7Z6 3/20 0.38
BCL2L1 Q07817 2/20 0.38
BAK1 Q16611 2/20 0.38
HSD11B1 P28845 1/20 0.38

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
SCHEMBL2859188 0.98 GCGR (0.48) GCGRCNR2TYRDHFRMGLL
SCHEMBL2864856 0.94 GCGR (0.43) GCGRCNR2MGLLKDM4EHSD11B1
SCHEMBL2859418 0.88 ESR1 (0.42) GCGRCNR2KDM4E
SCHEMBL2201379 0.84 GCGR (0.51) GCGRCNR2TYRDHFRMGLL
SCHEMBL2202192 0.84 GCGR (0.51) GCGRCNR2TYRDHFRMGLL
SCHEMBL2203973 0.84 GCGR (0.51) GCGRCNR2TYRDHFRMGLL
SCHEMBL2199195 0.84 GCGR (0.51) GCGRCNR2TYRDHFRMGLL
SCHEMBL2201817 0.84 GCGR (0.51) GCGRCNR2TYRDHFRMGLL
SCHEMBL2202743 0.84 GCGR (0.51) GCGRCNR2TYRDHFRMGLL
SCHEMBL2204801 0.82 GCGR (0.52) GCGRCNR2TYRDHFRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713449-B2 Polymer electrolytic material, polymer electrolytic part, membrane electrode assembly, and polymer electrolyte fuel cell TORAY INDUSTRIES, INC. (JP) 2010-05-11 US disclosed
CN-100364160-C Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell TORAY INDUSTRIES (JP) 2008-01-23 CN disclosed
US-20060180796-A1 Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell TORAY INDUSTRIES, INC. (JP) 2006-08-17 US disclosed
EP-1619735-A1 POLYMER ELECTROLYTE MATERIAL, POLYMER ELECTROLYTE PART, MEMBRANE ELECTRODE COMPOSITE AND POLYMER ELECTROLYTE TYPE FUEL CELL TORAY INDUSTRIES, INC. (JP) 2006-01-25 EP disclosed