⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1291885 | 0.87 | — | — | |
| SCHEMBL1224854 | 0.75 | — | — | |
| SCHEMBL30345414 | 0.75 | — | — | |
| SCHEMBL12803055 | 0.75 | — | — | |
| SCHEMBL31244584 | 0.75 | — | — | |
| SCHEMBL10523975 | 0.75 | — | — | |
| SCHEMBL29947655 | 0.75 | — | — | |
| SCHEMBL8351946 | 0.75 | — | — | |
| Arsenic SCHEMBL1224852 | 0.75 | — | — | |
| SCHEMBL29569548 | 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 |
|---|---|---|---|---|---|---|---|
| CN-109888254-B | Zinc-based battery positive electrode material based on aqueous solution, and preparation and application thereof | 华中科技大学 | 2021-02-05 | — | — | CN | disclosed |