⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16649009 | 1.00 | — | — | |
| SCHEMBL4841722 | 1.00 | — | — | |
| SCHEMBL153663 | 0.91 | THRB (0.33) | — | |
| SCHEMBL52 | 0.85 | CA2 (0.35) | — | |
| SCHEMBL27623481 | 0.85 | CA2 (0.35) | — | |
| SCHEMBL28249581 | 0.84 | THRB (0.37) | — | |
| SCHEMBL20135729 | 0.82 | CA2 (0.33) | — | |
| SCHEMBL3945657 | 0.82 | CA2 (0.33) | — | |
| SCHEMBL3945654 | 0.82 | CA2 (0.33) | — | |
| Hydrogen Peroxide SCHEMBL2051538 | 0.82 | CA2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2863469-B1 | NONAQUEOUS ELECTROLYTE SECONDARY CELL AND METHOD FOR USING SAME | MITSUBISHI CHEM CORP (JP) | 2017-11-22 | — | — | EP | disclosed |
| EP-2863469-A1 | NONAQUEOUS ELECTROLYTE SECONDARY CELL AND METHOD FOR USING SAME | Mitsubishi Chemical Corporation (JP) | 2015-04-22 | — | — | EP | disclosed |