⚠ 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 | |
|---|---|---|---|---|
| 2-Chloronicotinaldehyde SCHEMBL29828177 | 1.00 | — | — | |
| 2-Chloronicotinaldehyde SCHEMBL30893972 | 0.94 | TRIM24 (0.53) | — | |
| SCHEMBL20599365 | 0.85 | TRIM24 (0.48) | — | |
| SCHEMBL23948729 | 0.81 | TRIM24 (0.50) | — | |
| SCHEMBL23948348 | 0.80 | TRIM24 (0.48) | — | |
| SCHEMBL2936483 | 0.79 | — | — | |
| SCHEMBL30350016 | 0.79 | — | — | |
| SCHEMBL6631659 | 0.79 | — | — | |
| SCHEMBL1202412 | 0.79 | ALDH1A1 (0.47) | — | |
| SCHEMBL23457252 | 0.79 | NFE2L2 (0.43) | — |
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 1098 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117143013-A | Synthesis method of 2-chloronicotinic acid | 苏州开元民生科技股份有限公司 | 2023-12-01 | — | — | CN | claimed |
| CN-116867782-A | Pyrazole amide derivative | 豪夫迈·罗氏有限公司 | 2023-10-10 | — | — | CN | claimed |
| CN-113214182-B | Benzisothiazole compound and preparation method thereof | 佛山湘潭大学绿色智造研究院 | 2022-12-23 | — | — | CN | claimed |
| CN-110143911-B | Preparation method of N- (indole-N-formyl) -alpha-amino amide derivative | 浙江大学 | 2021-12-17 | — | — | CN | claimed |
| CN-113214182-A | Benzisothiazole compound and preparation method thereof | 佛山湘潭大学绿色智造研究院 | 2021-08-06 | — | — | CN | claimed |
| CN-107501171-B | Synthetic method of 2-chloro-3-pyridylaldehyde | 南京红太阳生物化学有限责任公司 | 2020-09-18 | — | — | CN | claimed |
| CN-109970710-A | Preparation method and electroluminescent application of indeno-pyridine derivatives | 大连理工大学 | 2019-07-05 | — | — | CN | claimed |
| CN-109796402-A | A kind of chloro- N of nicosulfuron intermediate 2-, the preparation method of N- dimethyl nicotinamide | 京博农化科技有限公司 | 2019-05-24 | — | — | CN | claimed |
| CN-108794470-A | A kind of synthetic method of 6- diazanyls -1H- pyrazolos [3,4-b] pyridine and its downstream product | 上海毕得医药技术有限公司 | 2018-11-13 | — | — | CN | claimed |
| US-10092786-B2 | Fire extinguishing composition comprising aldoketones compound | XI'AN WESTPEACE FIRE TECHNOLOGY CO., LTD. (CN) | 2018-10-09 | — | — | US | claimed |
| US-7452996-B2 | Substituted quinoline derivatives | NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) | 2008-11-18 | — | — | US | claimed |
| EP-1753723-B1 | SUBSTITUTED QUINOLINE DERIVATIVES AS MITOTIC KINESIN INHIBITORS | NOVARTIS VACCINES & DIAGNOSTIC (US) | 2008-08-13 | — | — | EP | claimed |
| EP-1753723-A1 | SUBSTITUTED QUINOLINE DERIVATIVES AS MITOTIC KINESIN INHIBITORS | Novartis Vaccines and Diagnostics, Inc. (US) | 2007-02-21 | — | — | EP | claimed |
| WO-2005113507-A1 | SUBSTITUTED QUINOLINE DERIVATIVES AS MITOTIC KINESIN INHIBITORS | NOVARTIS VACCINES AND DIAGNOSTICS INC. (US) | 2005-12-01 | — | — | WO | claimed |
| US-20050261337-A1 | N-(3-aminopropyl)-N- [1-(3-benzylquinolin-2-yl)- 2-methylpropyl]-3-fluoro-4-methylbenzamide; cancer; disorder mediated, at least in part by kinesin-related proteins | WANG WEIBO | 2005-11-24 | — | — | US | claimed |
| WO-2005105843-A2 | HIV PROTEASE INHIBITORS | ARPIDA A/S (DK) | 2005-11-10 | — | — | WO | claimed |
| US-20050239853-A1 | New compounds | BIOVITRUM AB (SE) | 2005-10-27 | — | — | US | claimed |
| WO-2005075471-A2 | THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | BIOVITRUM AB (SE) | 2005-08-18 | — | — | WO | claimed |
| CN-1029403-C | 2-oxo-1-oxa-8-azaspiro [4,5] decane derivatives, pharmaceutical compositions containing them and process for preparing same | RICHTER GEDEON VEGYESZET (HU) | 1995-08-02 | — | — | CN | claimed |
| CN-1049348-A | New 2-oxo-1-oxa--8-azaspiro [4,5] decane derivative contains their pharmaceutical composition and preparation method thereof | RICHTER GEDEON VEGYESZET (HU) | 1991-02-20 | — | — | CN | claimed |