⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28683653 | 0.73 | — | — | |
| SCHEMBL28683648 | 0.72 | — | — | |
| SCHEMBL27927332 | 0.67 | — | — | |
| SCHEMBL6427886 | 0.67 | — | — | |
| SCHEMBL1542058 | 0.66 | — | — | |
| SCHEMBL7152461 | 0.66 | — | — | |
| SCHEMBL11882608 | 0.65 | — | — | |
| SCHEMBL8896842 | 0.64 | — | — | |
| SCHEMBL842845 | 0.62 | — | — | |
| SCHEMBL4453774 | 0.62 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116396235-B | Synthetic method of isoxazoline insecticide and intermediate thereof | 宁波大学科学技术学院 | 2024-01-05 | — | — | CN | claimed |
| CN-116621765-A | Synthesis method and application of 2-indolone analogue containing alpha, beta-unsaturated ketone | 贵州省天然产物研究中心 | 2023-08-22 | — | — | CN | claimed |
| CN-116396235-A | Synthetic method of isoxazoline insecticide and intermediate thereof | 宁波大学科学技术学院 | 2023-07-07 | — | — | CN | claimed |
| CN-116396235-B | Synthetic method of isoxazoline insecticide and intermediate thereof | 宁波大学科学技术学院 | 2024-01-05 | — | — | CN | disclosed |
| CN-116621765-B | Synthesis method and application of 2-indolone analogue containing alpha, beta-unsaturated ketone | 贵州省天然产物研究中心 | 2023-10-13 | — | — | CN | disclosed |
| CN-116621765-A | Synthesis method and application of 2-indolone analogue containing alpha, beta-unsaturated ketone | 贵州省天然产物研究中心 | 2023-08-22 | — | — | CN | disclosed |
| CN-116396235-A | Synthetic method of isoxazoline insecticide and intermediate thereof | 宁波大学科学技术学院 | 2023-07-07 | — | — | CN | disclosed |