SCHEMBL2858581

SCHEMBL2858581

Cc1cc(S)c(-c2ccccc2)c(C)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.39
PDE4A P27815 3/20 0.39
PDE4C Q08493 3/20 0.39
PDE4D Q08499 3/20 0.39
ESR2 Q92731 1/20 0.39
TTR P02766 1/20 0.39
ALOX5 P09917 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ACHE P22303 1/20 0.36
PSMD14 O00487 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MMP2 P08253 1/20 0.36
GAA P10253 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
SCHEMBL11793443 0.85 PDE4B (0.40) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL2863657 0.85 PDE4B (0.39) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL1860044 0.82 HTT (0.50) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL27493715 0.79 ESR2 (0.48) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL3061032 0.76 CA1 (0.48) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL5479707 0.75 PDE4B (0.41) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL32679359 0.73 PDE4B (0.48) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL2865434 0.73 ALOX5 (0.38) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL2853743 0.73 ELANE (0.42) PDE4BPDE4APDE4CPDE4DESR2
SCHEMBL26072111 0.73 LMNA (0.44) PDE4BPDE4APDE4CPDE4DESR2

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
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
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