⚠ 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 | |
|---|---|---|---|---|
| Hydroxyamine SCHEMBL553035 | 0.89 | — | — | |
| Hydroxyamine SCHEMBL15869353 | 0.87 | — | — | |
| Hydroxyamine SCHEMBL3273025 | 0.87 | — | — | |
| Hydroxyamine SCHEMBL1248 | 0.87 | — | — | |
| Hydroxyamine SCHEMBL23327360 | 0.75 | — | — | |
| Hydroxyamine SCHEMBL8774592 | 0.75 | — | — | |
| Hydroxyamine SCHEMBL9773581 | 0.75 | — | — | |
| Hydroxyamine SCHEMBL2224589 | 0.75 | — | — | |
| Hydroxyamine SCHEMBL3149229 | 0.75 | — | — | |
| Hydroxyamine SCHEMBL3205135 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116003712-A | Star-shaped poly-1, 3-pentadiene elastomer with high trans-1, 4-structure content, preparation method and application thereof | 中国石油化工股份有限公司 | 2023-04-25 | — | — | CN | claimed |
| CN-116003660-A | Linear poly-1, 3-pentadiene elastomer with high trans-1, 4-structure content and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-04-25 | — | — | CN | claimed |
| CN-116003712-A | Star-shaped poly-1, 3-pentadiene elastomer with high trans-1, 4-structure content, preparation method and application thereof | 中国石油化工股份有限公司 | 2023-04-25 | — | — | CN | disclosed |
| CN-116003660-A | Linear poly-1, 3-pentadiene elastomer with high trans-1, 4-structure content and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-04-25 | — | — | CN | disclosed |
| WO-2008123387-A2 | WATER-BASED PAINT COMPOSITIONS AND MULTILAYER COATING FILM FORMING METHOD | KANSAI PAINT CO., LTD. (JP) | 2008-10-16 | — | — | WO | disclosed |