⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28622194 | 0.93 | — | — | |
| SCHEMBL28311060 | 0.87 | — | — | |
| SCHEMBL28209421 | 0.83 | — | — | |
| SCHEMBL8506166 | 0.82 | — | — | |
| SCHEMBL5359498 | 0.82 | — | — | |
| SCHEMBL134302 | 0.82 | — | — | |
| SCHEMBL28311061 | 0.77 | — | — | |
| SCHEMBL2679154 | 0.73 | — | — | |
| SCHEMBL180170 | 0.73 | — | — | |
| SCHEMBL6752941 | 0.73 | — | — |
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-117691055-A | Positive electrode material, battery and preparation method thereof | 北京车和家汽车科技有限公司 | 2024-03-12 | — | — | CN | disclosed |