⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13850114 | 0.77 | — | — | |
| SCHEMBL22171383 | 0.76 | — | — | |
| SCHEMBL11458933 | 0.72 | — | — | |
| SCHEMBL26113246 | 0.70 | — | — | |
| SCHEMBL27933909 | 0.70 | — | — | |
| SCHEMBL14610296 | 0.69 | — | — | |
| SCHEMBL21970725 | 0.69 | — | — | |
| SCHEMBL28214753 | 0.69 | — | — | |
| SCHEMBL9796673 | 0.69 | — | — | |
| SCHEMBL700062 | 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-117024483-A | Metallocene complex and application thereof | 海南贝欧亿科技有限公司 | 2023-11-10 | — | — | CN | disclosed |