⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11440982 | 0.86 | — | — | |
| SCHEMBL14786861 | 0.77 | ALDH1A1 (0.31) | — | |
| SCHEMBL14722406 | 0.75 | — | — | |
| SCHEMBL22097642 | 0.70 | — | — | |
| SCHEMBL2005873 | 0.70 | — | — | |
| SCHEMBL4033762 | 0.65 | — | — | |
| SCHEMBL60867 | 0.65 | — | — | |
| SCHEMBL56954 | 0.65 | — | — | |
| SCHEMBL819857 | 0.65 | KDM4E (0.32) | — | |
| SCHEMBL24335384 | 0.64 | — | — |
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-3667802-A1 | ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE | Sumitomo Seika Chemicals Co. Ltd. (JP) | 2020-06-17 | — | — | EP | disclosed |