SCHEMBL6778028

SCHEMBL6778028

[CH2]CC(c1ccc(OCC)cc1)c1ccc(F)c(Oc2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.49
CACNA1C Q13936 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
PTGS2 P35354 2/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 3/20 0.37
ATM Q13315 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CNR2 P34972 1/20 0.36
RELA Q04206 1/20 0.36
DUT P33316 1/20 0.36
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
HRH1 P35367 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
SCHEMBL7929051 0.91 LTA4H (0.53) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL8347323 0.83 LTA4H (0.44) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL27851786 0.79 LTA4H (0.44) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL5001520 0.79 LTA4H (0.44) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL10549602 0.76 LTA4H (0.42) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL10837294 0.76 LTA4H (0.42) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL9331962 0.75 LTA4H (0.43) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL9801523 0.75 LTA4H (0.43) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL8846649 0.75 LTA4H (0.43) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3
SCHEMBL7950948 0.75 LTA4H (0.43) LTA4HCACNA1CSLC6A2SLC6A4SLC6A3

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 98 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1788560-A Pesticide combination BAYER AG (DE) 2006-06-21 CN claimed
CN-1504091-A Insecticide composition 2004-06-16 CN claimed
CN-1307801-A Insecticide composition BAYER AG (DE) 2001-08-15 CN claimed
CN-1190870-A Insecticide composition BAYER AG (DE) 1998-08-19 CN claimed
CN-1061598-A Hydrazine class compound or its salt, its preparation method and contain the sterilant of this compounds ISHIHRA SANGYO KAISHA LTD (JP) 1992-06-03 CN claimed
JP-9136806-A None JP disclosed
EP-2747556-A2 PYRETHROID FORMULATIONS Vive Crop Protection Inc. (CA) 2014-07-02 EP disclosed
WO-2013041975-A2 PYRETHROID FORMULATIONS VIVE CROP PROTECTION INC. (CA) 2013-03-28 WO disclosed
CN-101389633-B Organic compounds NOVARTIS AG 2011-08-24 CN disclosed
CN-101300230-B N-(hetero) aryl indole derivatives as pesticides NOVARTIS AG 2011-04-13 CN disclosed
CN-101868147-A Fly control method DU PONT 2010-10-20 CN disclosed
CN-101868146-A Ectoparasite control method DU PONT 2010-10-20 CN disclosed
JP-H09136806-A MITE-CONTROLLING AGENT FOR SOIL TREATMENT DAINIPPON JOCHUGIKU CO LTD 1997-05-27 JP disclosed
EP-0746205-A1 SYNERGISTIC TERMITICIDAL COMPOSITION OF PYRETHROID AND N-PHENYL-PYRAZOLE RHONE-POULENC AGROCHIMIE (FR) 1996-12-11 EP disclosed
CN-1133590-A Butenol-triazolyl derivatives, their manufacture and use as microbicides BAYER AG (DE) 1996-10-16 CN disclosed
CN-1110678-A Ester compound, active agent for controlling noxious insect pests containing the same as active ingredient, intermediate for production of the ester compound, and process for producing the intermediat SUMITOMO CHEMICAL CO (JP) 1995-10-25 CN disclosed
WO-1995022902-A1 SYNERGISTIC TERMITICIDAL COMPOSITION OF PYRETHROID AND N-PHENYL-PYRAZOLE RHONE-POULENC AGROCHIMIE (FR) 1995-08-31 WO disclosed
CN-1084512-A 2-aryl hydrazono--3-ketone acid pyridine, their preparation method and as the application of agricultural chemicals HOECHST AG (DE) 1994-03-30 CN disclosed
CN-1076692-A Substituted pyrimidines, their production and use as pesticides and fungicides HOECHST AG (DE) 1993-09-29 CN disclosed
CN-1065659-A The insecticides of N-phenylcarbamate compound, its preparation method and control harmful organism ISHIHARA SANGYO KAISHA (JP) 1992-10-28 CN disclosed