⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL28454601 | 0.95 | FFAR3 (0.37) | — | |
| Methylene Chloride SCHEMBL28027618 | 0.95 | — | — | |
| SCHEMBL28674649 | 0.83 | — | — | |
| SCHEMBL11787604 | 0.81 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL28399014 | 0.79 | — | — | |
| SCHEMBL27654122 | 0.77 | — | — | |
| SCHEMBL371924 | 0.77 | — | — | |
| SCHEMBL11058800 | 0.77 | — | — | |
| SCHEMBL2407439 | 0.77 | — | — | |
| SCHEMBL6760286 | 0.75 | ALDH1A1 (0.32) | — |
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 103 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115785032-B | Synthesis method of intermediate alpha-chloroacetyl-gamma-butyrolactone and synthesis method of thiothiazole | 濮阳天源生物科技有限公司 | 2025-03-14 | — | — | CN | claimed |
| CN-116082134-B | Preparation method of compound 3, 5-dichloro-2-pentanone | 江苏省农药研究所股份有限公司 | 2025-02-18 | — | — | CN | claimed |
| CN-119118808-A | Synthesis method of 3-chloro-5-hydroxy-2-pentanone | 浙江医药股份有限公司昌海生物分公司 | 2024-12-13 | — | — | CN | claimed |
| CN-118724693-A | Preparation method of 3, 5-dichloro-2-pentanone | 潍坊中农联合化工有限公司 | 2024-10-01 | — | — | CN | claimed |
| CN-115850045-B | Production method and application of gamma-chloro-gamma-acetyl propanol | 江苏兄弟维生素有限公司 | 2024-07-19 | — | — | CN | claimed |
| CN-117776889-A | Hydrolysis method of alpha-chloro-alpha-acetyl-gamma-butyrolactone and application thereof | 江苏兄弟维生素有限公司 | 2024-03-29 | — | — | CN | claimed |
| CN-113831229-B | Green synthesis method of vitamin B1 intermediate | 浙江新和成股份有限公司 | 2023-06-30 | — | — | CN | claimed |
| CN-116082134-A | Preparation method of compound 3, 5-dichloro-2-pentanone | 江苏省农药研究所股份有限公司 | 2023-05-09 | — | — | CN | claimed |
| CN-115850045-A | Production method of gamma-chloro-gamma-acetopropanol, gamma-chloro-gamma-acetopropanol and application | 江苏兄弟维生素有限公司 | 2023-03-28 | — | — | CN | claimed |
| CN-115819370-A | Synthetic method of 4-methyl-5- (beta-hydroxyethyl) -thiazole | 福建菲恩新材料科技有限公司 | 2023-03-21 | — | — | CN | claimed |
| CN-103351359-B | Synthetic method of 3-(phenylmethyl)-5-(2-hydroxyethyl)-4-methyl-thiazoline chloride | ZHENG GUIFU | 2015-02-25 | — | — | CN | claimed |
| CN-104140420-A | Synthesis process of thiothiamine | JIANGSU BROTHER VITAMINS CO LTD | 2014-11-12 | — | — | CN | claimed |
| US-20110178300-A1 | NOVEL SYNTHESIS OF SUBSTITUTED 4-AMINO-PYRIMIDINES | DSM IP ASSETS B.V. (NL) | 2011-07-21 | — | — | US | claimed |
| EP-2307355-A1 | Novel synthesis of substituted 4-amino-pyrimidines | DSM IP Assets B.V. (NL) | 2011-04-13 | — | — | EP | claimed |
| CN-101948465-A | Method for preparing vitamin B1 intermediate | JIANGSU BROTHER VITAMINS CO LTD | 2011-01-19 | — | — | CN | claimed |
| WO-2010010113-A1 | Novel synthesis of substituted 4-amino-pyrimidines | DSM IP ASSETS B.V. (NL) | 2010-01-28 | — | — | WO | claimed |
| US-20080242863-A1 | Process For the Manufacture of a Precursor of Vitamin B1 | DSM IP ASSETS B.V. (NL) | 2008-10-02 | — | — | US | claimed |
| EP-1841745-B1 | PROCESS FOR THE MANUFACTURE OF A PRECURSOR OF VITAMIN B1 | DSM IP ASSETS BV (NL) | 2008-06-04 | — | — | EP | claimed |
| EP-1841745-A2 | PROCESS FOR THE MANUFACTURE OF A PRECURSOR OF VITAMIN B1 | DSMIP Assets B.V. (NL) | 2007-10-10 | — | — | EP | claimed |
| WO-2006079504-A2 | PROCESS FOR THE MANUFACTURE OF A PRECURSOR OF VITAMIN B1 | DSM IP ASSETS B.V. (NL) | 2006-08-03 | — | — | WO | claimed |