⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8054304 | 0.94 | — | — | |
| SCHEMBL2206 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL6541913 | 0.89 | — | — | |
| SCHEMBL9078915 | 0.89 | — | — | |
| SCHEMBL28235050 | 0.89 | ALDH1A1 (0.40) | — | |
| SCHEMBL11289440 | 0.89 | ALDH1A1 (0.40) | — | |
| Water SCHEMBL5438890 | 0.89 | — | — | |
| SCHEMBL30146908 | 0.89 | — | — | |
| SCHEMBL202872 | 0.84 | ALDH1A1 (0.38) | — | |
| SCHEMBL22028071 | 0.84 | ALDH1A1 (0.38) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117263822-A | Continuous synthesis method of trans-O- (3-chloro-2-propenyl) acetoxime ether | 淮阴工学院 | 2023-12-22 | — | — | CN | claimed |
| CN-115490611-A | Synthesis method of methoxylamine hydrochloride | 辽宁龙田化工科技有限公司 | 2022-12-20 | — | — | CN | claimed |
| EP-0030702-B1 | PROPIONIC-ACID ESTERS, PREPARATION OF THESE COMPOUNDS, HERBICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, USE OF SUCH COMPOUNDS AND AGENTS AS HERBICIDES | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1983-08-24 | — | — | EP | claimed |
| CN-117263822-A | Continuous synthesis method of trans-O- (3-chloro-2-propenyl) acetoxime ether | 淮阴工学院 | 2023-12-22 | — | — | CN | disclosed |
| CN-117263822-A | Continuous synthesis method of trans-O- (3-chloro-2-propenyl) acetoxime ether | 淮阴工学院 | 2023-12-22 | — | — | CN | disclosed |
| CN-115490611-A | Synthesis method of methoxylamine hydrochloride | 辽宁龙田化工科技有限公司 | 2022-12-20 | — | — | CN | disclosed |
| CN-115490611-A | Synthesis method of methoxylamine hydrochloride | 辽宁龙田化工科技有限公司 | 2022-12-20 | — | — | CN | disclosed |
| EP-0885878-A1 | Process for reparing o-substituted hydroxylammonium salts | BASF AKTIENGESELLSCHAFT (DE) | 1998-12-23 | — | — | EP | disclosed |
| US-5786374-A | FUNGICIDES, MICROBIOCIDES | NOVARTIS CORPORATION (US) | 1998-07-28 | — | — | US | disclosed |
| EP-0789692-A1 | BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM | Novartis AG (CH) | 1997-08-20 | — | — | EP | disclosed |
| WO-1996014305-A1 | BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM | NOVARTIS AG (CH) | 1996-05-17 | — | — | WO | disclosed |
| US-4329488-A | Propionic acid esters and herbicidal use thereof | HOFFMANN-LA ROCHE INC. (US) | 1982-05-11 | — | — | US | disclosed |