⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11373751 | 0.74 | — | — | |
| SCHEMBL28065644 | 0.74 | ALDH1A1 (0.48) | — | |
| SCHEMBL27291347 | 0.74 | ALDH1A1 (0.48) | — | |
| SCHEMBL27309320 | 0.74 | ALDH1A1 (0.42) | — | |
| SCHEMBL333268 | 0.73 | ALDH1A1 (0.50) | — | |
| Fluoride SCHEMBL27902339 | 0.72 | ALDH1A1 (0.40) | — | |
| SCHEMBL8201426 | 0.71 | — | — | |
| Water SCHEMBL27411605 | 0.70 | ALDH1A1 (0.47) | — | |
| Ammonia Solution, Strong SCHEMBL8854098 | 0.70 | ALDH1A1 (0.47) | — | |
| SCHEMBL9187097 | 0.69 | — | — |
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 379 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023206874-A1 | SACUBITRIL INTERMEDIATE, PREPARATION METHOD THEREFOR, AND USE THEREOF | 凯特立斯（深圳）科技有限公司 | 2023-11-02 | — | — | WO | claimed |
| EP-3838890-B1 | METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE | NEUBORON MEDTECH LTD (CN) | 2023-10-04 | — | — | EP | claimed |
| US-20230242555-A1 | METHOD FOR PREPARING 18F-BPA AND INTERMEDIATE | NEUBORON MEDTECH LTD. (CN) | 2023-08-03 | — | — | US | claimed |
| CN-112876502-B | Preparation method of N-trimethylsiloxyethoxycarbonyl-N-methyl-L/D-leucine | 上海嘉莱多生物技术有限责任公司 | 2022-01-11 | — | — | CN | claimed |
| CN-109526220-B | Tetrahydropyrimidine and tetrahydropyridino-diazepine compounds for use in the treatment of pain and pain related conditions | 埃斯特维制药股份公司 | 2021-12-21 | — | — | CN | claimed |
| WO-2021212880-A1 | METHOD FOR ASYMMETRICALLY PREPARING NICOTINE | 凯特立斯（深圳）科技有限公司 (CN) | 2021-10-28 | — | — | WO | claimed |
| CN-113166147-A | Novel tetrahydropyrimidine diazepine and tetrahydropyridine diazepine compounds for the treatment of pain and pain-related disorders | 埃斯特韦制药股份公司 | 2021-07-23 | — | — | CN | claimed |
| CN-112876502-A | Preparation method of N-trimethylsiloxyethoxycarbonyl-N-methyl-L/D-leucine | 上海嘉莱多生物技术有限责任公司 | 2021-06-01 | — | — | CN | claimed |
| CN-106496114-B | A kind of preparation method of aromatic aza cycle compound | 中国科学技术大学 | 2019-11-22 | — | — | CN | claimed |
| CN-107628975-B | Lysine derivative histone deacetylases inhibitor and its synthesis and application | GUIZHOU MEDICAL UNIVERSITY (CN) | 2019-10-29 | — | — | CN | claimed |
| CN-102924410-A | Preparation method and intermediate of ramelteon | CHINA RESOURCES SAIKE PHARMACEUTICAL CO LTD | 2013-02-13 | — | — | CN | claimed |
| CN-102827148-A | Hindered amine compound and preparation method thereof | CHANGCHUN APPLIED CHEMISTRY | 2012-12-19 | — | — | CN | claimed |
| CN-102731467-A | Novel intermediate of ticagrelor and method for preparing ticagrelor | BRIGHTGENE BIO MEDICAL TECHNOOGY CO LTD | 2012-10-17 | — | — | CN | claimed |
| CN-102584755-A | Alpha-aryl alanine compounds and preparation method thereof | UNIV NANCHANG | 2012-07-18 | — | — | CN | claimed |
| CN-102321057-A | The substituted methylsulfonyl amido-benzofuran derivative of N-, Preparation Method And The Use | BEIJING SUN NOVO PHARMACEUTICAL RES CO LTD | 2012-01-18 | — | — | CN | claimed |
| CN-102241697-A | Aliskiren intermediate and preparation method thereof | BRIGHTGENE BIO MEDICAL TECHNOLOGY CO LTD | 2011-11-16 | — | — | CN | claimed |
| CN-101974579-A | Method for preparing paroxetine intermediate by enzymatic selective hydrolysis in ionic liquid | ZHEJIANG JIUZHOU PHARM CO LTD | 2011-02-16 | — | — | CN | claimed |
| CN-101974604-A | Method for preparing paroxetine intermediate by enzyme resolution in ionic liquid | NANJING UNIVERSITY OF TECHNOLOGY | 2011-02-16 | — | — | CN | claimed |
| US-6891044-B2 | Indazole compounds and pharmaceutical compositions for Inhibiting protein kinases, and methods for their use | AGOURON PHARMACEUTICALS, INC. (US) | 2005-05-10 | — | — | US | claimed |
| US-20040220248-A1 | INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE | KANIA ROBERT STEVEN (US) | 2004-11-04 | — | — | US | claimed |