⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL29256204 | 0.96 | TRIM24 (0.44) | — | |
| SCHEMBL4620784 | 0.92 | TRIM24 (0.47) | — | |
| SCHEMBL4620542 | 0.92 | TRIM24 (0.57) | — | |
| SCHEMBL23723124 | 0.88 | ALDH1A1 (0.60) | — | |
| SCHEMBL4620698 | 0.88 | ALDH1A1 (0.60) | — | |
| SCHEMBL7952580 | 0.88 | ALDH1A1 (0.60) | — | |
| SCHEMBL9246687 | 0.88 | ALDH1A1 (0.60) | — | |
| SCHEMBL4619828 | 0.88 | TRIM24 (0.44) | — | |
| Bicarbonate SCHEMBL9854211 | 0.87 | TRIM24 (0.37) | — | |
| SCHEMBL4618953 | 0.83 | TRIM24 (0.57) | — |
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 287 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119320124-B | Sulphonated C4N nano-sheet, preparation method thereof and solid electrolyte | 中山大学 | 2025-03-11 | — | — | CN | claimed |
| CN-119320124-A | Sulphonated C4N nano-sheet, preparation method thereof and solid electrolyte | 中山大学 | 2025-01-17 | — | — | CN | claimed |
| WO-2023196684-A2 | GENETICALLY ENGINEERED PLANTS FOR INCREASED PRODUCTION OF VINDOLINE | NORTHEASTERN UNIVERSITY (US) | 2023-10-12 | — | — | WO | claimed |
| WO-2023280327-A1 | USE OF CYCLOHEXANETRIONE DERIVATIVE IN PREPARATION OF DRUG FOR ANIMALS | 广州英赛特生物技术有限公司 | 2023-01-12 | — | — | WO | claimed |
| CN-110963993-B | Cyclohexanetrione compound, preparation method and application thereof, and herbicide | 山东先达农化股份有限公司 | 2021-03-23 | — | — | CN | claimed |
| CN-110963993-A | Cyclohexanetrione compound, preparation method and application thereof, and herbicide | 山东先达农化股份有限公司 | 2020-04-07 | — | — | CN | claimed |
| CN-107439614-A | One kind specially controls planthopper agricultural chemicals | 安徽誉秀农业科技有限公司 | 2017-12-08 | — | — | CN | claimed |
| CN-106508908-A | Plant extract containing preparation for controlling diseases and pests of trees | 北京甸甸丰生物科技有限公司 | 2017-03-22 | — | — | CN | claimed |
| CN-106490443-A | A kind of preparation for being used for food fresh keeping containing plant extracts | 北京甸甸丰生物科技有限公司 | 2017-03-15 | — | — | CN | claimed |
| CN-106365216-A | Preparation containing plant extract and used for water treatment | 北京甸甸丰生物科技有限公司 | 2017-02-01 | — | — | CN | claimed |
| CN-106342893-A | Soybean field weed killer | 张勇健 | 2017-01-25 | — | — | CN | claimed |
| CN-103601640-B | A kind of preparation method of cyclohexanetriones compounds | MAX (RUDONG) CHEMICALS CO., LTD. (CN) | 2015-07-29 | — | — | CN | claimed |
| CN-103601640-A | Preparation method of cyclohexane trione compounds | MAX RUDONG CHEMICALS CO LTD | 2014-02-26 | — | — | CN | claimed |
| CN-103282386-A | Polymers functionalized with oxime compounds containing acyl groups | BRIDGESTONE CORP | 2013-09-04 | — | — | CN | claimed |
| CN-102731591-A | Anti-tumor anti-virus compound, preparation method and application thereof | JIANGSU ZEUKOV PHARMACEUTICAL SCIENCE & TECHNOLOGY INC | 2012-10-17 | — | — | CN | claimed |
| CN-102341360-A | PROCESS FOR CATALYTIC HALOGENATION OF DIOL | AKZO NOBEL NV | 2012-02-01 | — | — | CN | claimed |
| CN-1353685-A | Process for preparing 2,2,4, 4-tetra-substituted 1,3, 5-cyclohexanetriones | BASF AG (DE) | 2002-06-12 | — | — | CN | claimed |
| EP-0422493-B1 | Process for the preparation of cyclohexane trione carboxylic acid thiol esters and intermediate products | BASF AG (DE) | 1993-12-29 | — | — | EP | claimed |
| CN-87104101-A | 2-benzoyl-1,3,5-hexamethylene three ketones | — | 1988-04-06 | — | — | CN | claimed |
| EP-0013085-B1 | PROCESS FOR PREPARING PYROGALLOL | FBC LIMITED (GB) | 1983-02-16 | — | — | EP | claimed |