⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20157306 | 0.84 | HRH3 (0.31) | — | |
| SCHEMBL29307224 | 0.83 | — | — | |
| SCHEMBL21759227 | 0.77 | HRH3 (0.33) | — | |
| SCHEMBL24587491 | 0.77 | — | — | |
| SCHEMBL1608194 | 0.76 | — | — | |
| SCHEMBL17295373 | 0.76 | — | — | |
| SCHEMBL21759234 | 0.76 | — | — | |
| SCHEMBL29300091 | 0.76 | HRH3 (0.32) | — | |
| SCHEMBL14649729 | 0.76 | — | — | |
| SCHEMBL21759233 | 0.76 | — | — |
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-2024145811-A1 | ELECTROLYTE SOLUTION, SECONDARY BATTERY COMPRISING SAME, AND ELECTRIC DEVICE | 宁德时代新能源科技股份有限公司 | 2024-07-11 | — | — | WO | disclosed |