⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15305068 | 1.00 | — | — | |
| SCHEMBL3401523 | 0.83 | TSHR (0.47) | — | |
| SCHEMBL3401530 | 0.83 | TSHR (0.47) | — | |
| SCHEMBL4908024 | 0.77 | — | — | |
| SCHEMBL4368148 | 0.77 | — | — | |
| SCHEMBL587593 | 0.75 | — | — | |
| SCHEMBL7555690 | 0.75 | — | — | |
| SCHEMBL716528 | 0.75 | — | — | |
| SCHEMBL13703083 | 0.75 | — | — | |
| SCHEMBL1791605 | 0.75 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110999918-B | Application of S- (-) -bark beetle enol in attracting tianshan heavy-toothed bark beetle, attractant, attracting core and application | 中国林业科学研究院森林生态环境与保护研究所 | 2021-06-08 | — | — | CN | disclosed |
| CN-110999918-A | Application of S- (-) -bark beetle enol in attracting tianshan heavy-toothed bark beetle, attractant, attracting core and application | 中国林业科学研究院森林生态环境与保护研究所 | 2020-04-14 | — | — | CN | disclosed |
| EP-0982283-A2 | Method for the separation of polyfunctional alcohols from water-soluble salts in aqueous systems | Degussa-Hüls Aktiengesellschaft (DE) | 2000-03-01 | — | — | EP | disclosed |