⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL54996 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL27469698 | 0.93 | — | — | |
| Propane SCHEMBL28123177 | 0.93 | — | — | |
| Propane SCHEMBL28291511 | 0.93 | ALDH1A1 (0.56) | — | |
| Fluoride SCHEMBL27813392 | 0.93 | — | — | |
| Chloromethane SCHEMBL27512001 | 0.90 | — | — | |
| Bromoethane SCHEMBL27282477 | 0.88 | — | — | |
| SCHEMBL27536211 | 0.88 | — | — | |
| SCHEMBL4452989 | 0.77 | GAA (0.55) | — | |
| SCHEMBL7185101 | 0.75 | ALDH1A1 (0.65) | — |
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-106663551-B | Capacitor nonaqueous electrolytic solution and capacitor | 株式会社ADEKA | 2019-04-23 | — | — | CN | disclosed |
| CN-106663551-A | Nonaqueous electrolyte for capacitor, and capacitor | 株式会社ADEKA | 2017-05-10 | — | — | CN | disclosed |