⚠ 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 | |
|---|---|---|---|---|
| Zinc Ion SCHEMBL9345537 | 0.82 | GPR39 (0.33) | — | |
| Zinc Ion SCHEMBL29834953 | 0.82 | — | — | |
| Zinc Ion SCHEMBL30451269 | 0.82 | — | — | |
| SCHEMBL3083918 | 0.82 | — | — | |
| Zinc Ion SCHEMBL19508 | 0.82 | — | — | |
| Zinc Ion SCHEMBL11343192 | 0.82 | GPR39 (0.33) | — | |
| Zinc Ion SCHEMBL23928017 | 0.67 | — | — | |
| Zinc Ion SCHEMBL9559772 | 0.67 | — | — | |
| Zinc Ion SCHEMBL8588252 | 0.67 | — | — | |
| Zinc Ion SCHEMBL8356403 | 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-116598150-A | Self-supporting iron-zinc bimetallic selenide electrode and preparation method and application thereof | 中国科学院宁波材料技术与工程研究所 | 2023-08-15 | — | — | CN | disclosed |