⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL42308 | 0.94 | — | — | |
| SCHEMBL17771931 | 0.94 | — | — | |
| SCHEMBL19712285 | 0.89 | — | — | |
| SCHEMBL21065697 | 0.89 | — | — | |
| SCHEMBL27485920 | 0.89 | — | — | |
| SCHEMBL11835564 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL11747356 | 0.89 | — | — | |
| SCHEMBL43526 | 0.89 | — | — | |
| SCHEMBL4195834 | 0.89 | — | — | |
| SCHEMBL28189995 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024212829-A1 | PRE-EMBEDDING AGENT, PRE-EMBEDDED LITHIUM POSITIVE ELECTRODE, PRE-EMBEDDED SODIUM POSITIVE ELECTRODE, SECONDARY BATTERY COMPRISING SAME, METHOD FOR PRE-EMBEDDING LITHIUM, AND METHOD FOR PRE-EMBEDDING SODIUM | 复旦大学 | 2024-10-17 | — | — | WO | disclosed |