Allylbenzene

Allylbenzene

SCHEMBL9364455

C=CCc1ccccc1.O=S(=O)(Cl)Cl

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.50
MAOB P27338 1/20 0.46
CYP2C8 P10632 3/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 2/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
ALOX12 P18054 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA2 P00918 4/20 0.40
CA1 P00915 2/20 0.40
CA9 Q16790 2/20 0.40
FAAH O00519 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
ELANE P08246 1/20 0.40
PRTN3 P24158 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 SCHEMBL10522060 0.87 CNR2 (0.50) CNR2MAOBCYP2C8CYP2C9CYP2C19
Allylbenzene SCHEMBL44762 0.87 CNR2 (0.50) CNR2MAOBCYP2C8CYP2C9CYP2C19
Allylbenzene SCHEMBL11301260 0.87 CNR2 (0.50) CNR2MAOBCYP2C8CYP2C9CYP2C19
Allylbenzene SCHEMBL169220 0.86 MAOB (0.55) CNR2MAOBCYP2C8CYP2C9ALDH1A1
Allylbenzene SCHEMBL2478260 0.86 MAOB (0.60) CNR2MAOBALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL10325179 0.86 MAOB (0.60) CNR2MAOBALDH1A1CYP3A4TP53
Allylbenzene SCHEMBL21274 0.86
Allylbenzene SCHEMBL18040305 0.85 CNR2 (0.49) CNR2MAOBCYP2C8CYP2C9CYP2C19
Allylbenzene SCHEMBL1563634 0.85 CNR2 (0.53) CNR2MAOBCYP2C8CYP2C9CYP2C19
Allylbenzene SCHEMBL18040306 0.85 CNR2 (0.49) CNR2MAOBCYP2C8CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116790232-B Composite brine oil-in-water invert emulsion drilling fluid system and preparation method thereof 中石化胜利石油工程有限公司难动用项目管理中心 2024-06-07 CN claimed
CN-117487374-A Low-melting-point bright yellow disperse dye and preparation method and application thereof 上海安诺其集团股份有限公司 2024-02-02 CN claimed
CN-117164729-A Liquid crystal cellulose and preparation method and application thereof 天津工业大学 2023-12-05 CN claimed
CN-116790232-A Composite brine oil-in-water invert emulsion drilling fluid system and preparation method thereof 中石化胜利石油工程有限公司难动用项目管理中心 2023-09-22 CN claimed
CN-109503693-B Process for synthesizing Aramchol by using cholic acid as raw material 合肥工业大学 2021-04-06 CN claimed
CN-112472822-A Construction and application of endoplasmic reticulum targeted nano drug delivery system 浙江大学 2021-03-12 CN claimed
CN-111100044-A Preparation method of alkyl zinc sulfinate series compounds 鹤壁元昊化工有限公司 2020-05-05 CN claimed
CN-110981933-A Method for efficiently synthesizing Aramchol 合肥工业大学 2020-04-10 CN claimed
CN-109503693-A A kind of new process efficiently synthesizing Aramchol for raw material using cholic acid and arachidic acid 合肥工业大学 2019-03-22 CN claimed
CN-105906529-B Halogenated -2- diazonium -3- the oxo-pentanoic acid of 4- (4- nitrobenzene) methyl esters and preparation method thereof 江西富祥药业股份有限公司 2018-11-27 CN claimed
CN-105906529-A 4-halogenated-2-diazo-3-oxo-valeric acid(4-nitrobenzene)methyl ester and preparation method thereof 江西富祥药业股份有限公司 2016-08-31 CN claimed
CN-102633687-B The preparation method of a kind of para-orientation alkylbenzene sulfonyl chloride and technique 天津瑞岭化工有限公司 2016-06-08 CN claimed
CN-102993025-B Synthetic method of dimethyl cyclohexanediamine aromatic ring NANTONG HUAFENG CHEMICAL CO 2014-12-17 CN claimed
CN-102633687-A Method and technology for preparing p-substituted alkyl benzene sulfonyl chloride UNIV TIANJIN TECHNOLOGY 2012-08-15 CN claimed
CN-102633696-A Method and technology for preparing p-substituted alkyl benzene sulfonyl chloride by two-step synthesis UNIV TIANJIN TECHNOLOGY 2012-08-15 CN claimed
CN-101195593-B Industrial production method of alkylbenzene sulfonyl chloride ZHEJIANG JIAHUA GROUP CO LTD 2010-12-08 CN claimed
CN-101195593-A Industrial production method of alkylbenzene sulfonyl chloride ZHEJIANG JIAHUA GROUP CO LTD (CN) 2008-06-11 CN claimed
CN-1069278-A The manufacture method of plasticizing agent of phenyl alkylbenzene sulfonate REN ZHI (CN) 1993-02-24 CN claimed
JP-6116207-A None JP disclosed
US-4292191-A Activated peroxy compound bleaching compositions and bleaching detergent compositions COLGATE-PALMOLIVE COMPANY (US) 1981-09-29 US disclosed