⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15081221 | 0.79 | — | — | |
| SCHEMBL17417069 | 0.73 | — | — | |
| SCHEMBL969147 | 0.71 | — | — | |
| SCHEMBL969143 | 0.71 | — | — | |
| SCHEMBL17921274 | 0.71 | — | — | |
| SCHEMBL859268 | 0.69 | — | — | |
| SCHEMBL7153893 | 0.69 | CA1 (0.31) | — | |
| SCHEMBL17394692 | 0.69 | — | — | |
| Flurothyl SCHEMBL120937 | 0.68 | CA1 (0.38) | — | |
| SCHEMBL15403356 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2485316-B1 | NONAQUEOUS ELECTROLYTE BATTERY | MITSUBISHI CHEM CORP (JP) | 2018-11-28 | — | — | EP | claimed |