Benzene

Benzene

SCHEMBL252018

ClCCCl.c1ccccc1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.62
ALDH1A1 P00352 3/20 0.62
TP53 P04637 1/20 0.38
TDP1 Q9NUW8 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
Benzene SCHEMBL271140 0.80
1,2-Dichloroethane SCHEMBL127 0.79
1,2-Dichloroethane SCHEMBL5324114 0.79
1,2-Dichloroethane SCHEMBL4584447 0.79
1,2-Dichloroethane SCHEMBL19182749 0.79 TSHR (1.00) TSHRALDH1A1TDP1
1,2-Dichloroethane SCHEMBL6233635 0.79
Benzene SCHEMBL5792973 0.75 TSHR (0.47) TSHRALDH1A1TP53TDP1
Benzene SCHEMBL8506727 0.75 TAAR1 (0.35) TSHRALDH1A1
1,2-Dichloroethane SCHEMBL7267024 0.72
1,2-Dichloroethane SCHEMBL546582 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112858502-B Food contact material and method for detecting migration quantity of volatile organic compounds in product in oil-based simulant 徐州市质量技术监督综合检验检测中心(徐州市标准化研究中心) 2023-07-21 CN claimed
CN-104725174-A Preparation method for directly synthesizing biaryl compound by employing non-metallic catalysis UNIV XIANGTAN 2015-06-24 CN claimed
CN-1300963-A Process for preparing photoelectric organic drum for laser printing UNIV ZHEJIANG (CN) 2001-06-27 CN claimed
CN-112858502-B Food contact material and method for detecting migration quantity of volatile organic compounds in product in oil-based simulant 徐州市质量技术监督综合检验检测中心(徐州市标准化研究中心) 2023-07-21 CN disclosed
CN-108947906-B Method for preparing 1,3,4, 5-tetraaryl substituted pyrazole 青岛科技大学 2021-08-10 CN disclosed
CN-103124891-B Heat storage device and air conditioner equipped with same 松下知识产权经营株式会社 2017-02-08 CN disclosed
CN-103497070-B The method of hexanitro-six azepine isoamyl hereby alkane explosive spheroidization INST. OF CHEMICAL MATERIAL, CHINESE INST. OF ENGINEERING PHYSICS (CN) 2016-03-02 CN disclosed
CN-104725174-A Preparation method for directly synthesizing biaryl compound by employing non-metallic catalysis UNIV XIANGTAN 2015-06-24 CN disclosed
CN-101784893-B Monolithic adsorption material, and method and device for adsorbing sample using same GL SCIENCES INC 2014-08-06 CN disclosed
EP-2588455-A1 2 -QUINOLINYL- ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS Gilead Sciences, Inc. (US) 2013-05-08 EP disclosed
WO-2012003498-A1 2 -QUINOLINYL- ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-01-05 WO disclosed
CN-101003501-A Method for synthesizing coenzyme Q10 in high efficiency YINGLI TECH DEV CO LTD BEIJING (CN) 2007-07-25 CN disclosed
CN-1948330-A Preparation method of 1,4-dipregnene-16-beta-methyl-17-alpha-21-bihydroxy object UNIV ZHEJIANG (CN) 2007-04-18 CN disclosed
CN-1446802-A Chemosynthesis method of 1-chloroformyl-3-acetyl-2-imidazolidinone UNIV ZHEJIANG POLYTECHNIC (CN) 2003-10-08 CN disclosed
US-5634962-A Method for removing hazardous gases from enclosed structures SERV-TECH, IN. (US) 1997-06-03 US disclosed
CN-1092771-A The non-aromatic heterocycles that aminomethylene replaces PFIZER (US) 1994-09-28 CN disclosed
US-5015406-A Pour points, viscosity and viscosity index improving polymers CONOCO (US) 1991-05-14 US disclosed
US-4496600-A Flavoring with 2-mercaptoalkyl oxathiolanes and oxathianes GENERAL FOODS CORPORATION (US) 1985-01-29 US disclosed
US-4333799-A Purification and recovery of ethylene dichloride PPG INDUSTRIES, INC. (US) 1982-06-08 US disclosed
US-3994939-A BACTERICIDES PFIZER INC. (US) 1976-11-30 US disclosed