⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18918231 | 0.75 | — | — | |
| SCHEMBL29896471 | 0.73 | — | — | |
| SCHEMBL20462493 | 0.71 | KDM4E (0.31) | — | |
| SCHEMBL10188106 | 0.71 | — | — | |
| SCHEMBL28779546 | 0.69 | SLC22A6 (0.37) | — | |
| SCHEMBL18641300 | 0.69 | — | — | |
| SCHEMBL776391 | 0.69 | — | — | |
| SCHEMBL3127257 | 0.69 | — | — | |
| SCHEMBL245684 | 0.68 | — | — | |
| SCHEMBL576248 | 0.67 | TP53 (0.31) | — |
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-113490674-B | Compound, additive for electrolyte, electrochemical device, lithium ion secondary battery, and module | 大金工业株式会社 | 2024-06-07 | — | — | CN | disclosed |
| CN-111344891-B | Nonaqueous electrolyte and energy device using same | 三菱化学株式会社 | 2023-05-02 | — | — | CN | disclosed |