SCHEMBL27701919

SCHEMBL27701919

CCCCCC(c1ccc(O)c(C2CCCCC2)c1)c1ccc(O)c(C2CCCCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.46
BACE1 P56817 1/20 0.46
CNR1 P21554 10/20 0.44
CNR2 P34972 9/20 0.44
HSP90AA1 P07900 1/20 0.43
THRB P10828 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
ADRB2 P07550 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
SCHEMBL9807722 0.90 NUDT1 (0.49) NUDT1BACE1CNR1CNR2HSP90AA1
SCHEMBL10347780 0.90 NUDT1 (0.51) NUDT1BACE1CNR1CNR2HSP90AA1
SCHEMBL4061776 0.85 NUDT1 (0.50) NUDT1BACE1CNR1CNR2HSP90AA1
SCHEMBL28088196 0.83 NUDT1 (0.43) NUDT1BACE1CNR1CNR2HSP90AA1
SCHEMBL3178564 0.82 NUDT1 (0.53) NUDT1BACE1HSP90AA1THRBADRB2
SCHEMBL8503276 0.82 NUDT1 (0.47) NUDT1BACE1CNR1CNR2HSP90AA1
SCHEMBL3146459 0.79 NUDT1 (0.47) NUDT1BACE1HSP90AA1THRBADRB2
SCHEMBL11876985 0.78 GAA (0.51) NUDT1BACE1HSP90AA1THRBSLC6A3
SCHEMBL11873210 0.78 GAA (0.51) NUDT1BACE1HSP90AA1THRBSLC6A3
SCHEMBL11630462 0.78 CNR1 (0.40) CNR1CNR2SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105906509-B Method for producing bischloroformate compound 出光兴产株式会社 2018-04-06 CN disclosed
CN-104080839-B The manufacture method and polycarbonate resin particulate of polycarbonate resin particulate 东丽株式会社 2017-11-21 CN disclosed
CN-104017196-B Polycarbonate copolymer, coating liquid using same, and electrophotographic photoreceptor 出光兴产株式会社 2016-12-07 CN disclosed
CN-105906509-A Method for producing bischloroformate compound, polycarbonate oligomer having low monomer unit number, and solution containing bischloroformate compound 出光兴产株式会社 2016-08-31 CN disclosed
CN-103391958-B Polycarbonate copolymer, coating liquid using same, electrophotographic photoreceptor, and method for producing polycarbonate copolymer 出光兴产株式会社 2016-08-10 CN disclosed
CN-101048679-A Infrared absorbing filter OSAKA GAS CO LTD (JP) 2007-10-03 CN disclosed