⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29229638 | 0.76 | — | — | |
| SCHEMBL8449213 | 0.74 | — | — | |
| SCHEMBL1247910 | 0.71 | — | — | |
| SCHEMBL5840935 | 0.71 | — | — | |
| SCHEMBL28617265 | 0.70 | — | — | |
| SCHEMBL17911386 | 0.68 | — | — | |
| SCHEMBL28693433 | 0.68 | — | — | |
| SCHEMBL30559625 | 0.64 | MEN1 (0.36) | — | |
| SCHEMBL29044791 | 0.64 | MEN1 (0.36) | — | |
| SCHEMBL28425540 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119638755-A | Binuclear ruthenium pyridine coordination supermolecule self-assembled compound, and preparation method and application thereof | 江苏师范大学 | 2025-03-18 | — | — | CN | disclosed |
| CN-115141148-A | Bisimidazole ligand, ruthenium supermolecule self-assembly compound with imidazole ligands with different alkoxy chains, preparation method and application | 江苏师范大学 | 2022-10-04 | — | — | CN | disclosed |