⚠ 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 | |
|---|---|---|---|---|
| Propene SCHEMBL28279684 | 0.82 | — | — | |
| Ethylene SCHEMBL21749844 | 0.73 | — | — | |
| SCHEMBL19409149 | 0.73 | — | — | |
| SCHEMBL220011 | 0.73 | — | — | |
| SCHEMBL28533480 | 0.72 | — | — | |
| Acetic Acid SCHEMBL27507439 | 0.71 | — | — | |
| SCHEMBL150356 | 0.71 | — | — | |
| Propene SCHEMBL4305670 | 0.71 | — | — | |
| SCHEMBL27833369 | 0.69 | — | — | |
| Propene SCHEMBL8172306 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108376799-B | Nonaqueous electrolyte solution and method for producing nonaqueous electrolyte secondary battery | 丰田自动车株式会社 | 2021-08-06 | — | — | CN | disclosed |