⚠ 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 | |
|---|---|---|---|---|
| 1-Cyanoallyl Acetate SCHEMBL28614624 | 0.96 | TSHR (0.34) | — | |
| SCHEMBL371301 | 0.83 | ALDH1A1 (0.38) | — | |
| SCHEMBL11044129 | 0.82 | — | — | |
| SCHEMBL1960557 | 0.80 | — | — | |
| SCHEMBL1963001 | 0.78 | — | — | |
| SCHEMBL196173 | 0.78 | TSHR (0.35) | — | |
| SCHEMBL11637243 | 0.78 | TSHR (0.35) | — | |
| 1-Cyanoallyl Propionate SCHEMBL2456348 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL15283135 | 0.77 | TSHR (0.36) | — | |
| SCHEMBL15283780 | 0.77 | TSHR (0.36) | — |
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 254 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113461731-B | Preparation method of 3- (butoxy (methyl) phosphoryl) -1-cyano propyl acetate | 江苏七洲绿色科技研究院有限公司 | 2024-05-31 | — | — | CN | claimed |
| US-20240120535-A9 | GEL ELECTROLYTE PRECURSOR AND USE THEREOF | SVOLT ENERGY TECHNOLOGY CO., LTD. (CN) | 2024-04-11 | — | — | US | claimed |
| US-20230335793-A1 | GEL ELECTROLYTE PRECURSOR AND USE THEREOF | SVOLT ENERGY TECHNOLOGY CO., LTD. (CN) | 2023-10-19 | — | — | US | claimed |
| CN-116375765-B | Preparation method of 3- (methoxy (methyl) phosphoryl) -1-cyano propyl acetate | 江苏七洲绿色科技研究院有限公司 | 2023-09-19 | — | — | CN | claimed |
| CN-116375765-A | Preparation method of 3- (methoxy (methyl) phosphoryl) -1-cyano propyl acetate | 江苏七洲绿色科技研究院有限公司 | 2023-07-04 | — | — | CN | claimed |
| CN-112694417-B | Preparation method and device of 1-cyano-2-propenyl acetate | 山东新和成氨基酸有限公司 | 2023-06-23 | — | — | CN | claimed |
| CN-112094203-B | Preparation method of 1-cyano-2-propenyl acetate | 山东新和成氨基酸有限公司 | 2023-06-06 | — | — | CN | claimed |
| CN-113903976-B | Application method of ion-conducting gel copolymer for battery cell and battery cell | 蜂巢能源科技有限公司 | 2023-05-23 | — | — | CN | claimed |
| US-20230100363-A1 | MOLECULARLY IMPRINTED POLYMERS FOR EXTRACTION OF CANNABINOIDS AND USES THEREOF | ORCA HOLDINGS, LLC | 2023-03-30 | — | — | US | claimed |
| CN-113004325-B | Method for tubular continuous synthesis of (3-acetoxy-3-cyanopropyl) -methylphosphinic acid alkyl ester | 浙江新安化工集团股份有限公司 | 2023-03-17 | — | — | CN | claimed |
| CN-111253921-A | Filtrate reducer, preparation method thereof, water-based drilling fluid and application thereof | 中石化石油工程技术服务有限公司 | 2020-06-09 | — | — | CN | claimed |
| CN-111100036-A | Preparation method and device of 1-cyano-2-propenyl acetate | 山东新和成氨基酸有限公司 | 2020-05-05 | — | — | CN | claimed |
| US-7678870-B2 | Processable molecularly imprinted polymers | THE JOHNS HOPKINS UNIVERSITY (US) | 2010-03-16 | — | — | US | claimed |
| US-20070197746-A1 | Processable molecularly imprinted polymers | THE JOHNS HOPKINS UNIVERSITY | 2007-08-23 | — | — | US | claimed |
| EP-1733211-A4 | PROCESSABLE MOLECULARLY IMPRINTED POLYMERS | UNIV JOHNS HOPKINS (US) | 2007-05-30 | — | — | EP | claimed |
| EP-1733211-A1 | PROCESSABLE MOLECULARLY IMPRINTED POLYMERS | THE JOHNS-HOPKINS UNIVERSITY (US) | 2006-12-20 | — | — | EP | claimed |
| WO-2005103655-A1 | PROCESSABLE MOLECULARLY IMPRINTED POLYMERS | THE JOHNS HOPKINS UNIVERSITY (US) | 2005-11-03 | — | — | WO | claimed |
| EP-1509302-A1 | SOLID MYCOCTOXIN CARRIERS | Austria Wirtschaftsservice Gesellschaft mit beschränkter Haftung (AT) | 2005-03-02 | — | — | EP | claimed |
| WO-2003101580-A1 | SOLID MYCOCTOXIN CARRIERS | Austria Wirtschaftsservice Gesellschaft mit beschränkter Haftung (AT) | 2003-12-11 | — | — | WO | claimed |
| EP-0564924-B1 | 2-Oxoethyl derivatives as immunosuppressants | BAYER AG (US) | 1998-09-09 | — | — | EP | claimed |