⚠ 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 | |
|---|---|---|---|---|
| Tert-Butanol SCHEMBL29262529 | 0.94 | — | — | |
| Tert-Butanol SCHEMBL20503401 | 0.93 | ALDH1A1 (0.46) | — | |
| Tert-Butanol SCHEMBL3628777 | 0.93 | — | — | |
| Tert-Butanol SCHEMBL282 | 0.93 | — | — | |
| Tert-Butanol SCHEMBL788666 | 0.93 | ALDH1A1 (0.46) | — | |
| Benzene SCHEMBL6712802 | 0.88 | ALDH1A1 (0.43) | — | |
| Tert-Butanol SCHEMBL25297067 | 0.86 | ALDH1A1 (0.42) | — | |
| Tert-Butanol SCHEMBL21268474 | 0.86 | — | — | |
| Tert-Butanol SCHEMBL183182 | 0.86 | — | — | |
| Tert-Butanol SCHEMBL22800861 | 0.86 | — | — |
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 315 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-121574302-A | Stable formula for preparing anionic polyacrylamide by thiol-ene click chemical synthesis method | 广东首信环保材料科技有限公司 | 2026-02-27 | — | — | CN | claimed |
| CN-119874640-A | Method for preparing dicyclopentadiene monoepoxide | 中国石油化工股份有限公司 | 2025-04-25 | — | — | CN | claimed |
| CN-118184595-A | Method for preparing key intermediate of cinnolamine ester | 四川奥邦古得药业有限公司 | 2024-06-14 | — | — | CN | claimed |
| CN-114752308-B | Two-component acrylic ester structural adhesive | 北京天山新材料技术有限公司 | 2024-02-20 | — | — | CN | claimed |
| CN-117209438-A | Preparation method of 1,2,4 triazole-3-ketone compound | 五邑大学 | 2023-12-12 | — | — | CN | claimed |
| CN-114106078-B | Preparation method of (22E, 24R) -3 alpha, 5-ring-5 alpha-ergosta-7, 22-diene-6-ketone | 郑州郑氏化工产品有限公司 | 2023-06-06 | — | — | CN | claimed |
| CN-111647247-B | Resin composition for high-frequency high-speed copper-clad plate and application thereof | 上海材料研究所 | 2023-05-05 | — | — | CN | claimed |
| CN-115594645-B | Synthesis method of flurarana | 山东亚华生物科技有限公司 | 2023-04-14 | — | — | CN | claimed |
| CN-113956391-B | Polymer filtrate reducer and preparation method and application thereof | 中海石油(中国)有限公司湛江分公司 | 2023-03-31 | — | — | CN | claimed |
| CN-115677691-A | Preparation method of benzonaphthyridine amide anticancer drug SN28049 and analogues thereof | 潍坊富邦药业有限公司 | 2023-02-03 | — | — | CN | claimed |
| CN-102286065-B | Novel abietane-type diterpene derivative as well as preparation method and application thereof | SHANGHAI INST MATERIA MEDICA | 2012-11-14 | — | — | CN | claimed |
| CN-102617441-A | N-hydroxy ester preparation method | UNIV SOOCHOW | 2012-08-01 | — | — | CN | claimed |
| CN-102617319-A | Method for oxidizing alcohol into aldehyde or ketone | SUZHOU KETONE BIO PHARMA CO LTD | 2012-08-01 | — | — | CN | claimed |
| CN-102584509-A | Preparation method of amide | UNIV SOOCHOW | 2012-07-18 | — | — | CN | claimed |
| CN-101768075-B | 15-carbonyl steviol derivative and salt, preparation method and application | UNIV CHINA PHARMA | 2012-05-23 | — | — | CN | claimed |
| CN-102286065-A | Novel abietane-type diterpene derivative as well as preparation method and application thereof | — | 2011-12-21 | — | — | CN | claimed |
| CN-101177446-B | Novel method for stereo-selective chemosynthesis of drospirenone | SHANGHAI DRUG INST CHINESE ACADEMY OF SCIENCES | 2011-06-15 | — | — | CN | claimed |
| CN-101693897-A | Gene with antioxidation function and application thereof | UNIV SHANGHAI | 2010-04-14 | — | — | CN | claimed |
| CN-101671682-A | Gene with antioxidation function, coded protein and application thereof | UNIV SHANGHAI | 2010-03-17 | — | — | CN | claimed |
| CN-101177446-A | Novel method for stereo-selective chemosynthesis of drospirenone | SHANGHAI DRUG INST CHINESE ACA (CN) | 2008-05-14 | — | — | CN | claimed |