SCHEMBL2879317

SCHEMBL2879317

CCCc1c(O)cc(-c2ccccc2)c(O)c1CCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.50
PDE4B Q07343 3/20 0.45
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
PDE4A P27815 2/20 0.41
PDE4C Q08493 2/20 0.41
PDE4D Q08499 2/20 0.41
ALOX5 P09917 2/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
BCL2L1 Q07817 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
PTPN1 P18031 2/20 0.38
PTPN2 P17706 1/20 0.38
PTPN6 P29350 1/20 0.38
JUN P05412 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 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
SCHEMBL2863890 0.90 HPGD (0.47) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL7039237 0.87 BACE1 (0.45) BACE1PDE4BALOX5ALDH1A1HPGD
SCHEMBL27681638 0.86 BACE1 (0.50) BACE1PDE4BCNR1CNR2PDE4A
SCHEMBL7039242 0.83 BACE1 (0.47) BACE1PDE4BCNR1CNR2PDE4A
SCHEMBL2866342 0.82 BACE1 (0.54) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL2870986 0.81 BACE1 (0.42) BACE1PDE4BCNR1CNR2PDE4A
SCHEMBL31545785 0.80 BACE1 (0.43) BACE1PDE4BCNR1CNR2PDE4A
SCHEMBL9745855 0.78 ALOX5 (0.47) BACE1CNR1CNR2ALOX5ALDH1A1
SCHEMBL22497560 0.78 LTB4R (0.41) BACE1PDE4BALOX5ALDH1A1HPGD
SCHEMBL10435692 0.77 BACE1 (0.42) BACE1CNR1CNR2ALOX5ALDH1A1

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