Benzene

Benzene

SCHEMBL8850413

CC(C)C(=O)O.c1ccccc1

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.53
SLC7A5 Q01650 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
PTGS2 P35354 1/20 0.40
GAA P10253 1/20 0.39
CYP2D6 P10635 1/20 0.38
SRC P12931 1/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
RECQL P46063 1/20 0.38
RNPEP Q9H4A4 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 SCHEMBL27482544 0.96 TP53 (0.50) TP53SLC7A5ALDH1A1MEN1MAPT
SCHEMBL8986517 0.92 TP53 (0.53) TP53SLC7A5ALDH1A1MEN1MAPT
Hydrogen Peroxide SCHEMBL28852493 0.91
SCHEMBL2531259 0.91 TP53 (0.61) TP53SLC7A5ALDH1A1MEN1MAPT
SCHEMBL405938 0.91 TP53 (0.61) TP53SLC7A5ALDH1A1MEN1MAPT
SCHEMBL17767389 0.91 TP53 (0.61) TP53SLC7A5ALDH1A1MEN1MAPT
SCHEMBL5940223 0.91 TP53 (0.61) TP53SLC7A5ALDH1A1MEN1MAPT
SCHEMBL4640114 0.91 TP53 (0.61) TP53SLC7A5ALDH1A1MEN1MAPT
SCHEMBL2774033 0.91 TP53 (0.61) TP53SLC7A5ALDH1A1MEN1MAPT
SCHEMBL10857351 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108430445-A Spice composition 西姆莱斯股份公司 2018-08-21 CN claimed
CN-104727167-A Decoloration-resistant dye auxiliary agent JIANGSU ZHONGHAI HEAVY MACH CO LTD 2015-06-24 CN claimed
CN-117940268-A Method for producing a multiphase composite 3D object 巴斯夫欧洲公司 2024-04-26 CN disclosed
CN-117642292-A Composition for 3D printing, 3D printed object formed therefrom and method of forming the object 巴斯夫欧洲公司 2024-03-01 CN disclosed
CN-117280002-A Radiation curable composition for producing support substructure for 3D photopolymer jetting 巴斯夫欧洲公司 2023-12-22 CN disclosed
CN-106754581-B Saccharomyces cerevisiae can be promoted to produce bacillus and its application of alcohol and flavor substance simultaneously 江南大学 2019-11-26 CN disclosed
CN-106754580-B Saccharomyces cerevisiae can be promoted to produce bacillus and its application of alcohol and flavor substance simultaneously 江南大学 2019-11-26 CN disclosed
CN-109952116-A Solid non aqueous gels air fumet 陶氏环球技术有限责任公司 2019-06-28 CN disclosed
CN-109922781-A 1- [(the 4R) -4- methylcyclohexene -1- base] purposes of ethyl ketone as aromachemicals 巴斯夫欧洲公司 2019-06-21 CN disclosed
CN-109071727-A Alkali swellable emulsion polymers 路博润先进材料公司 2018-12-21 CN disclosed
WO-2018213433-A1 HYDROGEL MEDICAL ADHESIVES BIOCURE, INC. (US) 2018-11-22 WO disclosed
CN-101755238-B Dual photoinitiator, photocurable composition, use thereof and process for producing a three dimensional article 3D SYSTEMS INC 2013-01-02 CN disclosed
CN-102186650-A System and resin for rapid prototyping HUNTSMAN ADV MAT SWITZERLAND 2011-09-14 CN disclosed
CN-101755238-A Dual photoinitiator, photo curable composition, their purposes and the method for preparing three-dimensional article HUNTSMAN ADV MAT AMERICAS INC 2010-06-23 CN disclosed
CN-100417683-C Rubber composition, crosslinkable rubber compositions, and crosslinked articles KURARAY CO (JP) 2008-09-10 CN disclosed
CN-1298780-C Binder resin compositions, production process, and use thereof JUJO PAPER CO LTD (JP) 2007-02-07 CN disclosed
CN-1747996-A Rubber composition, crosslinkable rubber compositions, and crosslinked articles KURARAY CO (JP) 2006-03-15 CN disclosed
CN-1610723-A Binder resin compositions, production process, and use thereof JUJO PAPER CO LTD (JP) 2005-04-27 CN disclosed
EP-0807268-A1 CROSSLINKED TINTED POLYMERS Novartis AG (CH) 1997-11-19 EP disclosed
WO-1996024076-A1 CROSSLINKED TINTED POLYMERS NOVARTIS AG (CH) 1996-08-08 WO disclosed