Allylbenzene

Allylbenzene

SCHEMBL169220

C=CCc1ccccc1.C=O

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.55
CNR2 P34972 2/20 0.47
ALDH1A1 P00352 2/20 0.46
CYP3A4 P08684 2/20 0.46
TP53 P04637 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
ALOX12 P18054 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
XDH P47989 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
ARG2 P78540 1/20 0.41
CALM1 P0DP23 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
AKR1B1 P15121 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH2 P05091 1/20 0.40
GAA P10253 1/20 0.40

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
Allylbenzene SCHEMBL2478260 0.95 MAOB (0.60) MAOBCNR2ALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL21274 0.95
Allylbenzene SCHEMBL10325179 0.95 MAOB (0.60) MAOBCNR2ALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL9016271 0.92 MAOB (0.52) MAOBCNR2ALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL5697714 0.92 MAOB (0.57) MAOBCNR2ALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL3704854 0.92 MAOB (0.57) MAOBCNR2ALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL16752547 0.92 MAOB (0.57) MAOBCNR2ALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL131215 0.92 MAOB (0.57) MAOBCNR2ALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL5593566 0.92 MAOB (0.57) MAOBCNR2ALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL2051491 0.92 MAOB (0.57) MAOBCNR2ALDH1A1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020213640-A1 AROMATIC-AMINE RESIN, MALEIMIDE RESIN, CURABLE RESIN COMPOSITION, AND CURED OBJECT OBTAINED THEREFROM 日本化薬株式会社 2020-10-22 WO claimed
CN-106699532-B A kind of preparation method of 1,1- difluoro Tetrahydronaphthalencompounds compounds 浙江师范大学 2019-09-06 CN claimed
CN-106748771-B A kind of preparation method of 6- fluoroalkyl ketone 浙江师范大学 2019-08-06 CN claimed
CN-106748771-A A kind of preparation method of 6 fluoroalkyl ketone 浙江师范大学 2017-05-31 CN claimed
CN-106699532-A Preparing method of 1,1-difluoro tetrahydronaphthalene compound 浙江师范大学 2017-05-24 CN claimed
CN-103173748-A Chemical tin plating solution LI ZHENPING 2013-06-26 CN claimed
CN-102405917-A Insecticidal composition NINGBO LANDING ELECTRONIC TECHNOLOGY CO LTD 2012-04-11 CN claimed
CN-101124911-B Insecticide composition containing rhodojaponin III and chlopyrifos UNIV SOUTH CHINA AGRICULT 2011-06-22 CN claimed
CN-101161069-B Insecticidal composition of Chinese azalea extract III and theasaponine UNIV SOUTH CHINA AGRICULT 2011-04-27 CN claimed
CN-101926337-A Pesticide composite of tea saponin and UNIV SOUTH CHINA AGRICULT 2010-12-29 CN claimed
CN-101743969-A Mixed insecticide of tea saponin and neonicotine insecticide UNIV SOUTH CHINA AGRICULT 2010-06-23 CN claimed
CN-101743968-A Mixed insecticide of tea saponin and organophosphate insecticide UNIV SOUTH CHINA AGRICULT 2010-06-23 CN claimed
CN-101720773-A Insecticidal composition of tea saponin and rotenone UNIV SOUTH CHINA AGRICULT 2010-06-09 CN claimed
CN-101720766-A Insecticidal composition of tea saponin and pleocidin UNIV SOUTH CHINA AGRICULT 2010-06-09 CN claimed
CN-101696216-A Method for preparing 1,3,4-thiadiazole-p-[3,2-alpha] pyridine derivative by one-pot method UNIV NORTHWEST NORMAL 2010-04-21 CN claimed
CN-101434607-A Method for synthesizing polyolefin nucleating agent aldehyde alcohol compound UNIV SHENZHEN (CN) 2009-05-20 CN claimed
CN-101161069-A Insecticidal composition of Chinese azalea extract III and theasaponine UNIV SOUTH CHINA AGRICULT (CN) 2008-04-16 CN claimed
CN-101156627-A Citrus corrosion protection antistaling agent with tea saponin UNIV SOUTH CHINA AGRICULT (CN) 2008-04-09 CN claimed
CN-101124911-A Insecticide composition containing rhodojaponin III and chlopyrifos UNIV SOUTH CHINA AGRICULT (CN) 2008-02-20 CN claimed
CN-100366600-C Method for producing alkylbenzaldehydes MITSUBISHI GAS CHEMICAL CO (JP) 2008-02-06 CN claimed