⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20180050 | 0.72 | — | — | |
| SCHEMBL19343697 | 0.69 | — | — | |
| SCHEMBL20180048 | 0.69 | — | — | |
| SCHEMBL22192803 | 0.65 | — | — | |
| SCHEMBL25478609 | 0.61 | — | — | |
| SCHEMBL25477022 | 0.61 | — | — | |
| SCHEMBL27710433 | 0.61 | — | — | |
| SCHEMBL20207 | 0.61 | — | — | |
| Fluoride SCHEMBL160907 | 0.58 | — | — | |
| Fluoride SCHEMBL23062667 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11916195-B2 | Electrolyte solution, electrochemical device, lithium ion secondary battery, and module | DAIKIN INDUSTRIES, LTD. (JP) | 2024-02-27 | — | — | US | disclosed |