⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1101294 | 0.95 | — | — | |
| Carbamic Acid SCHEMBL5865828 | 0.71 | — | — | |
| SCHEMBL2504316 | 0.64 | TSHR (0.31) | — | |
| SCHEMBL559238 | 0.63 | — | — | |
| SCHEMBL170478 | 0.63 | — | — | |
| SCHEMBL23116592 | 0.63 | — | — | |
| Bromide SCHEMBL5193586 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL7986636 | 0.60 | — | — | |
| SCHEMBL11567815 | 0.60 | — | — | |
| SCHEMBL7135209 | 0.60 | — | — |
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 100 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113248457-B | Substrate for synthesizing beta-Se amino acid, and preparation method and application thereof | 上海交通大学 | 2024-05-17 | — | — | CN | claimed |
| CN-113717151-B | Pure organic room temperature phosphorescent compound, preparation method and application thereof | 北京化工大学 | 2023-12-15 | — | — | CN | claimed |
| CN-116333026-A | Preparation method of dydrogesterone intermediate | 北京济美堂医药研究有限公司 | 2023-06-27 | — | — | CN | claimed |
| CN-113354544-B | Method for preparing diaminodiphenylmethane by selectively breaking C-N bond | 中国科学院山西煤炭化学研究所 | 2023-03-31 | — | — | CN | claimed |
| CN-113717151-A | Pure organic room temperature phosphorescent compound, preparation method and application thereof | 北京化工大学 | 2021-11-30 | — | — | CN | claimed |
| CN-113354544-A | Method for preparing diaminodiphenylmethane by selectively breaking C-N bond | 中国科学院山西煤炭化学研究所 | 2021-09-07 | — | — | CN | claimed |
| CN-113248457-A | Substrate for synthesizing beta-Se amino acid and preparation method and application thereof | 上海交通大学 | 2021-08-13 | — | — | CN | claimed |
| CN-112851468-A | Preparation method of 3, 5-dimethoxy-4-methylbenzoic acid | 上海睿腾医药科技有限公司 | 2021-05-28 | — | — | CN | claimed |
| CN-110963980-A | Method for synthesizing β -S amino acid | 上海交通大学 | 2020-04-07 | — | — | CN | claimed |
| CN-110950761-A | Synthesis method of latamoxef 7-site side chain | 山东金城柯瑞化学有限公司 | 2020-04-03 | — | — | CN | claimed |
| CN-104098728-B | Alcoholysis method of ethylene-vinyl acetate copolymer | 中国石油化工集团公司 | 2017-05-24 | — | — | CN | claimed |
| CN-106187934-A | A kind of synthetic method of carbenicillin sodium impurity G | 上海上药新亚药业有限公司 | 2016-12-07 | — | — | CN | claimed |
| CN-106117159-A | A kind of synthetic method of carbenicillin sodium impurity D | 上海上药新亚药业有限公司 | 2016-11-16 | — | — | CN | claimed |
| CN-104193699-B | A kind of micromolecular compound and synthetic method and application | TECHNODERMA MEDICINES Pte. Ltd. (CN) | 2016-05-25 | — | — | CN | claimed |
| CN-105111191-A | Key intermediate for synthesis of CDK9 inhibitor, preparation method and application thereof | MEDCHEMEXPRESS CHINA CO LTD | 2015-12-02 | — | — | CN | claimed |
| CN-104673499-A | Method for preparing conjugated linoleic acid | FENGYI SHANGHAI BIOTECHNOLOGY R & D CT CO LTD | 2015-06-03 | — | — | CN | claimed |
| CN-104193699-A | Small-molecule compound as well as synthesis method and application thereof | JIAXING TEKELUO BIOTECHNOLOGY CO LTD | 2014-12-10 | — | — | CN | claimed |
| CN-104098728-A | Alcoholysis method of ethylene-vinyl acetate copolymer | CHINA PETROCHEMICAL CORP | 2014-10-15 | — | — | CN | claimed |
| CN-103450081-A | Preparation method of meptazinol hydrochloride intermediate 1-methyl-3-(3-oxo-1-cyclohexyl-1-alkenyl)-6H-azepin-2-one | SHANGHAI SUN SAIL PHARMACEUTICAL SCIENCE & TECHNOLOGY CO LTD | 2013-12-18 | — | — | CN | claimed |
| CN-1683354-A | 4-hydroxy pyrone compounds with anti-HIV activity, preparing method and use | UNIV BEIJING (CN) | 2005-10-19 | — | — | CN | claimed |