⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Benzenethiol SCHEMBL5698196 | 1.00 | ALDH1A1 (0.40) | — | |
| Benzenethiol SCHEMBL27793298 | 0.96 | ALDH1A1 (0.38) | — | |
| Benzenethiol SCHEMBL28274212 | 0.96 | — | — | |
| Benzenethiol SCHEMBL15809974 | 0.96 | — | — | |
| Benzenethiol SCHEMBL10796991 | 0.96 | ALDH1A1 (0.43) | — | |
| Benzenethiol SCHEMBL28862443 | 0.96 | ALDH1A1 (0.43) | — | |
| Benzenethiol SCHEMBL490106 | 0.96 | ALDH1A1 (0.43) | — | |
| SCHEMBL22047568 | 0.96 | ALDH1A1 (0.43) | — | |
| Benzenethiol SCHEMBL2574156 | 0.96 | ALDH1A1 (0.43) | — | |
| Benzenethiol SCHEMBL67 | 0.96 | — | — |
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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106749119-B | N- acyl homoserine lactones class compound, preparation method and the application that class containing phenyl ring replaces | 郑州大学 | 2019-02-01 | — | — | CN | claimed |
| CN-108623636-A | A kind of phosphazene compound and its preparation method and application of fluorine-containing thiophenol substitution | 广东广山新材料股份有限公司 | 2018-10-09 | — | — | CN | claimed |
| CN-106833406-A | A kind of high refractive index nano inorganic matter hydridization photovoltaic encapsulation material | 杭州福斯特光伏材料股份有限公司 | 2017-06-13 | — | — | CN | claimed |
| CN-106596504-A | Method of ultrasensitive detection on cyanide in water body | 汪竹青 | 2017-04-26 | — | — | CN | claimed |
| CN-1709925-B | Resin of zinc acrylate or copper acrylate containing capsaicin function group, its preparation and use | OCEAN UNIV CHINA | 2011-10-26 | — | — | CN | claimed |
| CN-1709925-A | Resin of zinc acrylate or copper acrylate containing capsaicin function group, its preparation and use | CHINESE OCEANOGRAPHY UNIV (CN) | 2005-12-21 | — | — | CN | claimed |
| CN-106257271-B | A kind of composite material and preparation method based on Surface enhanced Raman scattering technology | 中国科学院宁波材料技术与工程研究所 | 2019-08-06 | — | — | CN | disclosed |
| CN-106596504-B | A kind of method of cyanide in super sensitivity detection water body | 安庆师范大学 | 2019-07-30 | — | — | CN | disclosed |
| CN-106749119-B | N- acyl homoserine lactones class compound, preparation method and the application that class containing phenyl ring replaces | 郑州大学 | 2019-02-01 | — | — | CN | disclosed |
| CN-106833406-A | A kind of high refractive index nano inorganic matter hydridization photovoltaic encapsulation material | 杭州福斯特光伏材料股份有限公司 | 2017-06-13 | — | — | CN | disclosed |
| CN-106749119-A | N acyl homoserine lactones classes compound, its preparation method and application that class containing phenyl ring replaces | 郑州大学 | 2017-05-31 | — | — | CN | disclosed |
| CN-106596504-A | Method of ultrasensitive detection on cyanide in water body | 汪竹青 | 2017-04-26 | — | — | CN | disclosed |
| CN-106414402-A | Aryloyl(oxy or amino)pentafluorosulfanylbenzene compound, pharmaceutically acceptable salt thereof, and prodrugs thereof | 宇部兴产株式会社 | 2017-02-15 | — | — | CN | disclosed |
| US-4334082-A | ION EXCHANGE RESINS, MEMBRANES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-06-08 | — | — | US | disclosed |
| EP-0048964-A2 | Dialkyl perfluoro-omega-fluoroformyl diesters and process for their preparation | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-04-07 | — | — | EP | disclosed |
| US-4281092-A | ELASTOMERS RESISTANT TO ENVIRONMENTAL ATTACK | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1981-07-28 | — | — | US | disclosed |
| US-4247713-A | REACTING A PERFLUOROESTER ALKYL ETHER WITH SULFUR TRIOXIDE; CHEMICAL INTERMEDIATES FOR THE VINYL MONOMERS OF FLUOROPOLYMERS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1981-01-27 | — | — | US | disclosed |
| EP-0011853-A2 | Vulcanizable fluorinated copolymers | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1980-06-11 | — | — | EP | disclosed |
| US-4138426-A | USED AS INTERMEDIATES TO FORM FLUORINE-SUBSTITUTED POLYMERS CONTAINING ESTER, CARBOXYLIC ACID AND NITRILE GROUPS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1979-02-06 | — | — | US | disclosed |
| US-4131740-A | Alkyl perfluoro-ω-fluoroformyl esters and their preparation | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-12-26 | — | — | US | disclosed |