⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27602905 | 0.80 | CHRM2 (0.31) | — | |
| SCHEMBL4303259 | 0.79 | — | — | |
| SCHEMBL27668123 | 0.76 | — | — | |
| SCHEMBL28209061 | 0.74 | — | — | |
| SCHEMBL9579063 | 0.73 | — | — | |
| SCHEMBL1479943 | 0.72 | SMN1; SMN2 (0.52) | — | |
| SCHEMBL2190099 | 0.69 | — | — | |
| Sulfuric Acid SCHEMBL9472665 | 0.67 | CA5A (0.33) | — | |
| SCHEMBL28479003 | 0.67 | CHRM2 (0.42) | — | |
| SCHEMBL28481165 | 0.67 | CHRM2 (0.42) | — |
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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1665802-A | Bisarylsulfonamide compounds and their use in cancer therapy | CYCLACEL LTD (GB) | 2005-09-07 | — | — | CN | claimed |
| CN-115160970-B | Preparation method of water-based polyurethane heat-sealing adhesive | 四川汇利实业有限公司 | 2023-12-15 | — | — | CN | disclosed |
| US-11814348-B2 | Oxidizing liquid media for chemical transformations | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2023-11-14 | — | — | US | disclosed |
| US-11396492-B2 | Direct oxidative amination of hydrocarbons | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2022-07-26 | — | — | US | disclosed |
| US-11078136-B2 | Oxidation of alkane to alkene | THE SCRIPPS RESEARCH INSTITUTE (US) | 2021-08-03 | — | — | US | disclosed |
| US-20210163503-A1 | OXIDIZING LIQUID MEDIA FOR CHEMICAL TRANSFORMATIONS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2021-06-03 | — | — | US | disclosed |
| US-10858301-B2 | Direct oxidation of olefins to oxygenated species | THE SCRIPPS RESEARCH INSTITUTE (US) | 2020-12-08 | — | — | US | disclosed |
| US-20200377448-A1 | DIRECT OXIDATIVE AMINATION OF HYDROCARBONS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2020-12-03 | — | — | US | disclosed |
| EP-3717454-A1 | DIRECT OXIDATIVE AMINATION OF HYDROCARBONS | The Scripps Research Institute (US) | 2020-10-07 | — | — | EP | disclosed |
| EP-3634925-A1 | OXIDATION OF ALKANE TO ALKENE | The Scripps Research Institute (US) | 2020-04-15 | — | — | EP | disclosed |
| WO-2018218176-A1 | OXIDATION OF ALKANE TO ALKENE | THE SCRIPPS RESEARCH INSTITUTE (US) | 2018-11-29 | — | — | WO | disclosed |
| WO-2018218186-A1 | DIRECT OXIDATION OF OLEFINS TO OXYGENATED SPECIES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2018-11-29 | — | — | WO | disclosed |
| WO-2018218171-A1 | OXIDIZING LIQUID MEDIA FOR CHEMICAL TRANSFORMATIONS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2018-11-29 | — | — | WO | disclosed |
| CN-104053661-B | The thienopyrimidines inhibitor of atypical protein kinase C | 癌症研究技术有限公司 | 2018-06-19 | — | — | CN | disclosed |
| CN-101228202-B | Polythiourethane polymerizable composition and optical resin comprising the same | MITSUI CHEMICALS INC | 2011-05-18 | — | — | CN | disclosed |
| CN-1955306-B | Method of saccharomycetes bio-synthesing, of producing optical pure adenosine methionine and its culture solution | SHANGHAI INST PHARM INDUSTRY | 2011-03-16 | — | — | CN | disclosed |
| CN-101805356-A | Preparation methods of sulbenicillin sodium and injection thereof | HUNAN XIANGYAO PHARMACEUTICAL CO LTD | 2010-08-18 | — | — | CN | disclosed |
| CN-101228202-A | Polythiourethane polymerizable composition and optical resin comprising the same | MITSUI CHEMICALS INC (JP) | 2008-07-23 | — | — | CN | disclosed |
| CN-1955306-A | Method of saccharomycetes bio-synthesing, producing optical pure adenosine methionine and its culture solution | SHANGHAI MEDICIAL INDUSTRY INS (CN) | 2007-05-02 | — | — | CN | disclosed |
| CN-1665802-A | Bisarylsulfonamide compounds and their use in cancer therapy | CYCLACEL LTD (GB) | 2005-09-07 | — | — | CN | disclosed |