⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28854595 | 0.93 | — | — | |
| SCHEMBL28117764 | 0.91 | — | — | |
| SCHEMBL29153727 | 0.91 | — | — | |
| SCHEMBL28854585 | 0.87 | — | — | |
| SCHEMBL28112123 | 0.83 | — | — | |
| SCHEMBL27922581 | 0.83 | — | — | |
| SCHEMBL28870248 | 0.83 | — | — | |
| SCHEMBL28555617 | 0.83 | — | — | |
| SCHEMBL25253188 | 0.82 | — | — | |
| SCHEMBL7154939 | 0.82 | — | — |
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-116395899-A | Treatment method of crude cobalt nickel hydroxide extraction wastewater | 长沙有色冶金设计研究院有限公司 | 2023-07-07 | — | — | CN | disclosed |