⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29353789 | 1.00 | — | — | |
| SCHEMBL613602 | 0.97 | TAAR1 (0.56) | — | |
| SCHEMBL10877707 | 0.91 | TAAR1 (0.50) | — | |
| SCHEMBL630242 | 0.86 | TAAR1 (0.45) | — | |
| Toluene SCHEMBL28315319 | 0.85 | ALDH1A1 (0.54) | — | |
| SCHEMBL4410065 | 0.84 | TRPA1 (0.46) | — | |
| SCHEMBL2213709 | 0.83 | ALDH1A1 (0.61) | — | |
| SCHEMBL348159 | 0.83 | ALDH1A1 (0.61) | — | |
| SCHEMBL4399626 | 0.81 | TAAR1 (0.74) | — | |
| SCHEMBL9200966 | 0.81 | TAAR1 (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
Appears in 2582 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115959962-B | Visible light-promoted halogenated alkane hydrodehalogenation method | 中国科学院兰州化学物理研究所 | 2025-05-23 | — | — | CN | claimed |
| CN-115850002-B | Method for hydrodehalogenating halogenated alkane | 中国科学院兰州化学物理研究所 | 2025-05-23 | — | — | CN | claimed |
| CN-116375643-B | Deaconitine derivative and preparation method and application thereof | 中国人民解放军海军军医大学 | 2025-04-01 | — | — | CN | claimed |
| CN-119101052-A | Matrine-triazole derivative and synthesis method thereof | 吉林医药学院 | 2024-12-10 | — | — | CN | claimed |
| CN-118221691-B | Methylenedioxybenzo [ b ] [1,4] diazepine [5,6-e ] triazinone derivative and pharmaceutically acceptable salt, preparation method and application thereof | 常熟理工学院 | 2024-10-15 | — | — | CN | claimed |
| CN-114651898-B | Triazole feed additive for improving immunity as well as preparation method and application thereof | 天津溢佳同惠科技集团有限公司 | 2024-04-05 | — | — | CN | claimed |
| CN-114773330-B | Butylphthalide-oxa/thiadiazole compound and preparation method and application thereof | 贵州医科大学 | 2024-03-15 | — | — | CN | claimed |
| CN-114560813-B | Benzimidazole MK2 allosteric inhibitor and preparation method and application thereof | 南京中医药大学 | 2023-09-12 | — | — | CN | claimed |
| CN-116715624-A | Synthesis method of N-alkylated pyrithione compound | 信阳师范学院 | 2023-09-08 | — | — | CN | claimed |
| CN-116709872-A | CsPbBr (I) with high stability 3 Quantum dot and preparation method of wide-color-gamut backlight device | 北京科技大学 | 2023-09-05 | — | — | CN | claimed |
| CN-111848511-A | Synthesis method of montelukast sodium intermediate | 山东百诺医药股份有限公司 | 2020-10-30 | — | — | CN | claimed |
| CN-111004228-A | GSK-3 β/ChE dual inhibitor and preparation method and application thereof | 中国药科大学 | 2020-04-14 | — | — | CN | claimed |
| US-10590145-B2 | Tetrahydrothiopyranopyrimidine derivatives as anti-HIV agent | SHANDONG UNIVERSITY (CN) | 2020-03-17 | — | — | US | claimed |
| US-20200031844-A1 | Tetrahydrothiopyranopyrimidine derivatives as anti-HIV agent | SHANDONG UNIVERSITY (CN) | 2020-01-30 | — | — | US | claimed |
| CN-110724047-A | Method for preparing aromatic carboxylic acid compound | 中国科学院大连化学物理研究所 | 2020-01-24 | — | — | CN | claimed |
| CN-106946777-B | One kind containing the preparation and its application of organic thermotropic delayed fluorescence material of 9,9- dimethyl acridinium unit | 大连理工大学 | 2019-06-07 | — | — | CN | claimed |
| CN-108299435-A | 13- ethanol amine matrine derivatives prepare and its application | 广西大学 | 2018-07-20 | — | — | CN | claimed |
| CN-107325058-A | Two fragrant methylene disulfide compounds and preparation method and application | 苏州大学 | 2017-11-07 | — | — | CN | claimed |
| CN-104844514-A | Diarylpyrazole compound as well as preparation method and application thereof | UNIV SHANDONG | 2015-08-19 | — | — | CN | claimed |
| EP-1754705-A2 | Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders | Genentech, Inc. (US) | 2007-02-21 | — | — | EP | claimed |