⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9723868 | 1.00 | — | — | |
| SCHEMBL899065 | 0.72 | — | — | |
| SCHEMBL726542 | 0.72 | — | — | |
| SCHEMBL27249 | 0.72 | — | — | |
| SCHEMBL3188709 | 0.72 | — | — | |
| SCHEMBL204773 | 0.72 | — | — | |
| SCHEMBL259025 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL11619049 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL6767103 | 0.69 | — | — | |
| SCHEMBL6767102 | 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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1043229-C | Beta-aminovinyl ketone and preparation method thereof | RHONE POULENC AGROCHIMIE (FR) | 1999-05-05 | — | — | CN | claimed |
| CN-1215047-A | Use of 'beta'-amino-vinyl ketone in preparation of 'beta'-diketone | RHONE POULENC AGROCHIMIE (FR) | 1999-04-28 | — | — | CN | claimed |
| CN-1125940-A | Beta-aminovinyl ketones, process for their preparation and their use in the preparation of beta-diketones | RHONE POULENC AGROCHIMIE (FR) | 1996-07-03 | — | — | CN | claimed |
| CN-117736120-A | Beta-fluoroalkyl-beta-amino vinyl ketone compound, and preparation method and application thereof | 南京工业大学 | 2024-03-22 | — | — | CN | disclosed |
| CN-113710331-B | Antimicrobial mixture | 西姆莱斯股份公司 | 2024-03-22 | — | — | CN | disclosed |
| CN-115925583-A | Preparation method of beta-fluoroalkyl-beta-aminovinyl ketone compound | 南京工业大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-105025712-A | Antimicrobial compositions | SYMRISE AG | 2015-11-04 | — | — | CN | disclosed |
| CN-1110476-C | Use of 'beta'-amino-vinyl ketone in preparation of 'beta'-diketone | RHONE POULENC AGROCHIMIE (FR) | 2003-06-04 | — | — | CN | disclosed |
| CN-1110476-C | Use of 'beta'-amino-vinyl ketone in preparation of 'beta'-diketone | RHONE POULENC AGROCHIMIE (FR) | 2003-06-04 | — | — | CN | disclosed |
| CN-1043229-C | Beta-aminovinyl ketone and preparation method thereof | RHONE POULENC AGROCHIMIE (FR) | 1999-05-05 | — | — | CN | disclosed |
| CN-1043229-C | Beta-aminovinyl ketone and preparation method thereof | RHONE POULENC AGROCHIMIE (FR) | 1999-05-05 | — | — | CN | disclosed |
| CN-1215047-A | Use of 'beta'-amino-vinyl ketone in preparation of 'beta'-diketone | RHONE POULENC AGROCHIMIE (FR) | 1999-04-28 | — | — | CN | disclosed |
| CN-1215047-A | Use of 'beta'-amino-vinyl ketone in preparation of 'beta'-diketone | RHONE POULENC AGROCHIMIE (FR) | 1999-04-28 | — | — | CN | disclosed |
| CN-1125940-A | Beta-aminovinyl ketones, process for their preparation and their use in the preparation of beta-diketones | RHONE POULENC AGROCHIMIE (FR) | 1996-07-03 | — | — | CN | disclosed |
| CN-1125940-A | Beta-aminovinyl ketones, process for their preparation and their use in the preparation of beta-diketones | RHONE POULENC AGROCHIMIE (FR) | 1996-07-03 | — | — | CN | disclosed |
| CN-1117483-A | Preparation of 2,3,6-trimethylphenol | BASF AG (DE) | 1996-02-28 | — | — | CN | disclosed |
| US-5169958-A | Reacting, 3-amino-2-propen-1-ones with magnesium halide in solvent | BASF AKTIENGESELLSCHAFT (DE) | 1992-12-08 | — | — | US | disclosed |