⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6746379 | 0.97 | — | — | |
| SCHEMBL18030003 | 0.81 | — | — | |
| SCHEMBL3439739 | 0.81 | — | — | |
| Bromide SCHEMBL8507110 | 0.79 | — | — | |
| SCHEMBL28380644 | 0.79 | — | — | |
| Iodide SCHEMBL10782326 | 0.79 | — | — | |
| SCHEMBL18226106 | 0.77 | — | — | |
| SCHEMBL29674979 | 0.77 | — | — | |
| Bromide SCHEMBL5273521 | 0.77 | — | — | |
| SCHEMBL18871025 | 0.75 | TSHR (0.32) | — |
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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110372493-B | Method for synthesizing diflunisal and derivatives thereof by one-step method | 北京师范大学 | 2020-09-08 | — | — | CN | claimed |
| CN-110372544-B | Iron-catalyzed synthesis method of biaryl and derivatives thereof | 北京师范大学 | 2020-08-18 | — | — | CN | claimed |
| CN-104817438-B | A kind of alkylation of fluorine-containing aryl halide | 上海万溯化学有限公司 | 2018-01-16 | — | — | CN | claimed |
| CN-106278779-A | A kind of preparation method of 1,1 disubstituted olefins | 中国科学院长春应用化学研究所 | 2017-01-04 | — | — | CN | claimed |
| CN-101508625-B | Method for synthesis of alkyl substituted benzene with direct cross coupling of cobalt salt catalysed fragrant halogen and haloalkane | UNIV SICHUAN | 2012-09-05 | — | — | CN | claimed |
| WO-2010136544-A1 | PROCESS FOR CATALYTIC RING-OPENING POLYMERIZATION OF CYCLIC MONOMERS | TECHNISCHE UNIVERSITÄT DORTMUND (DE) | 2010-12-02 | — | — | WO | claimed |
| CN-101508625-A | Method for synthesis of alkyl substituted benzene with direct cross coupling of cobalt salt catalysed fragrant halogen and haloalkane | UNIV SICHUAN (CN) | 2009-08-19 | — | — | CN | claimed |
| CN-101395115-A | Preparation of alkyl ketene dimers | HERCULES INC (US) | 2009-03-25 | — | — | CN | claimed |
| CN-101291909-A | Processes and intermediates | VERTEX PHARMA (US) | 2008-10-22 | — | — | CN | claimed |
| US-3978161-A | METALLIC SODIUM, UNSATURATED HYDROCARBON POLYMER, TERT-AMINE CHELATING AGENT | THE GENERAL TIRE & RUBBER COMPANY (US) | 1976-08-31 | — | — | US | claimed |
| CN-113166446-B | Polyimide film with low dielectric constant and low hygroscopicity and preparation method thereof | 聚酰亚胺先端材料有限公司 | 2023-07-07 | — | — | CN | disclosed |
| US-20210113712-A1 | METHODS FOR PREPARING CELL TARGETING CONJUGATES AND CONJUGATES OBTAINABLE BY SAID METHODS | LINXIS B V (NL) | 2021-04-22 | — | — | US | disclosed |
| US-20200345862-A1 | TRANSITION METAL-BASED FUNCTIONAL MOIETIES FOR PREPARING CELL TARGETING CONJUGATES | LINXIS B V (NL) | 2020-11-05 | — | — | US | disclosed |
| EP-3727465-A2 | TRANSITION METAL-BASED FUNCTIONAL MOIETIES FOR PREPARING CELL TARGETING CONJUGATES | LinXis B.V. (NL) | 2020-10-28 | — | — | EP | disclosed |
| CN-110372493-B | Method for synthesizing diflunisal and derivatives thereof by one-step method | 北京师范大学 | 2020-09-08 | — | — | CN | disclosed |
| CN-101291909-A | Processes and intermediates | VERTEX PHARMA (US) | 2008-10-22 | — | — | CN | disclosed |
| US-6689919-B1 | SOLUBLE POLY(OXYFLUOROPHENYLENE) COMPOUNDS WITH EXCELLENT HEAT RESISTANCE, MEMBRANE-FORMABILITY AND CHEMICAL STABILITY | JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) | 2004-02-10 | — | — | US | disclosed |
| CN-1049436-C | Novel reactive thiophosphate derivatives of thia(dia)zole acetic acid and process for preparing the same | LUCKY LTD (KR) | 2000-02-16 | — | — | CN | disclosed |
| CN-1104640-A | Novel reactive thiophosphate derivatives of thia(dia)zole acetic acid and process for preparing the same | LUCKY LTD (KR) | 1995-07-05 | — | — | CN | disclosed |
| US-3978161-A | METALLIC SODIUM, UNSATURATED HYDROCARBON POLYMER, TERT-AMINE CHELATING AGENT | THE GENERAL TIRE & RUBBER COMPANY (US) | 1976-08-31 | — | — | US | disclosed |