Benzene

Benzene

SCHEMBL7930559

CCOOCC.c1ccccc1

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.33
TP53 P04637 1/20 0.32
NQO1 P15559 1/20 0.32

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
SCHEMBL27065 0.85
Benzene SCHEMBL28105567 0.84 LTA4H (0.31) LTA4H
Ammonia Solution, Strong SCHEMBL9929382 0.80
SCHEMBL8073104 0.80
Bicarbonate SCHEMBL10901198 0.75 ALDH1A1 (0.44)
Benzene SCHEMBL11464832 0.73 LTA4H (0.33) LTA4HTP53NQO1
Benzene SCHEMBL665216 0.73 ALDH1A1 (0.39) LTA4HTP53NQO1
Ether SCHEMBL41293 0.73 ALDH1A1 (0.39)
Benzene SCHEMBL9989943 0.73 ALDH1A1 (0.39) LTA4HTP53NQO1
SCHEMBL5013419 0.73

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021109611-A1 CATALYST FOR HYDROGENOLYSIS AND PREPARATION METHOD THEREFOR 红宝丽集团股份有限公司 2021-06-10 WO disclosed
CN-109884859-A A kind of photosensitive epoxy acrylic resin composition of high flexible, high parsing 浙江福斯特新材料研究院有限公司 2019-06-14 CN disclosed
CN-105936674-B A kind of preparation method of ultraviolet light 3D printing alginic acid hydrogel matrix 武汉纺织大学 2018-06-26 CN disclosed
CN-104861216-B A kind of preparation method of ultraviolet light 3D printing hydrogel matrix 武汉纺织大学 2017-03-15 CN disclosed
CN-105999391-A Preparation method of alginate hydrogel dressing 武汉纺织大学 2016-10-12 CN disclosed
US-6307072-B2 Method for production of oxygen-containing organic compound NIPPON SHOKUBAI CO., LTD. (JP) 2001-10-23 US disclosed
US-20010012909-A1 Method for production of oxygen-containing organic compound NIPPON SHOKUBAI CO., LTD. (JP) 2001-08-09 US disclosed
EP-1112777-A1 Method for production of oxygen-containing organic compound NIPPON SHOKUBAI KABUSHIKI KAISHA (JP) 2001-07-04 EP disclosed