⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL233908 | 1.00 | — | — | |
| SCHEMBL28016195 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL7128655 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL31146935 | 0.94 | — | — | |
| SCHEMBL27729110 | 0.94 | — | — | |
| Ethane SCHEMBL10381112 | 0.88 | — | — | |
| Ethyne SCHEMBL29456765 | 0.88 | — | — | |
| Ethylene SCHEMBL28887996 | 0.88 | CA1 (0.40) | — | |
| Ethylene SCHEMBL28525646 | 0.88 | — | — | |
| Potassium Ion SCHEMBL28228387 | 0.88 | — | — |
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-118056309-A | Flame-retardant nonaqueous electrolyte and secondary battery using same | 国立大学法人京都大学 | 2024-05-17 | — | — | CN | disclosed |