⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26955 | 0.82 | — | — | |
| SCHEMBL29845721 | 0.82 | — | — | |
| SCHEMBL1309227 | 0.82 | — | — | |
| SCHEMBL396142 | 0.67 | — | — | |
| SCHEMBL19064463 | 0.67 | — | — | |
| Zinc Ion SCHEMBL585867 | 0.67 | — | — | |
| SCHEMBL448958 | 0.67 | — | — | |
| SCHEMBL302011 | 0.67 | — | — | |
| SCHEMBL10482223 | 0.67 | — | — | |
| Lithium Ion SCHEMBL553026 | 0.67 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118619346-A | Two-dimensional transition metal chalcogenide nanosheets and powder intercalation preparation method and application thereof | 中国科学院化学研究所 | 2024-09-10 | — | — | CN | disclosed |