⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18421425 | 0.79 | — | — | |
| SCHEMBL17646116 | 0.79 | — | — | |
| SCHEMBL497554 | 0.78 | MEN1 (0.30) | — | |
| SCHEMBL28735876 | 0.75 | — | — | |
| SCHEMBL15992157 | 0.75 | KDM4E (0.40) | — | |
| SCHEMBL646618 | 0.73 | MEN1 (0.33) | — | |
| Ether SCHEMBL22529145 | 0.68 | — | — | |
| SCHEMBL27149654 | 0.68 | — | — | |
| SCHEMBL108295 | 0.68 | — | — | |
| SCHEMBL2005142 | 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-114747045-A | Negative electrode, method for preparing same by electrolytic deposition and preparation device thereof | 汉阳大学校ERICA产学协力团 | 2022-07-12 | — | — | CN | disclosed |