⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL323331 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL28032630 | 0.89 | — | — | |
| Methylamine SCHEMBL27814155 | 0.84 | — | — | |
| SCHEMBL207623 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28904718 | 0.67 | — | — | |
| SCHEMBL28173311 | 0.67 | — | — | |
| Fluoride SCHEMBL27459933 | 0.67 | — | — | |
| SCHEMBL2799412 | 0.63 | — | — | |
| SCHEMBL20845275 | 0.63 | — | — | |
| SCHEMBL1140879 | 0.63 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103181017-B | Non-aqueous electrolyte secondary battery | 株式会社艾迪科 | 2016-08-10 | — | — | CN | disclosed |
| CN-103098291-B | Nonaqueous electrolytic solution secondary battery | ADEKA CORP. (JP) | 2016-04-27 | — | — | CN | disclosed |
| CN-103181017-A | Non-aqueous electrolyte secondary battery | ADEKA CORP | 2013-06-26 | — | — | CN | disclosed |
| CN-103098291-A | Non-aqueous electrolyte secondary battery | ADEKA CORP | 2013-05-08 | — | — | CN | disclosed |