⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1055321 | 0.72 | — | — | |
| SCHEMBL5712009 | 0.72 | ALDH1A1 (0.30) | — | |
| SCHEMBL21382636 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL5323293 | 0.69 | — | — | |
| SCHEMBL4100051 | 0.69 | — | — | |
| SCHEMBL338658 | 0.69 | — | — | |
| SCHEMBL4758776 | 0.67 | — | — | |
| SCHEMBL29010394 | 0.67 | — | — | |
| SCHEMBL15704471 | 0.67 | — | — | |
| SCHEMBL423208 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119812477-A | Lithium secondary battery and nonaqueous electrolyte used therein | 三菱化学株式会社 | 2025-04-11 | — | — | CN | disclosed |
| CN-119133604-A | Lithium secondary battery and nonaqueous electrolyte used therein | 三菱化学株式会社 | 2024-12-13 | — | — | CN | disclosed |