⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL790973 | 0.55 | — | — | |
| SCHEMBL3398929 | 0.55 | — | — | |
| SCHEMBL2794634 | 0.52 | — | — | |
| SCHEMBL23115349 | 0.47 | — | — | |
| SCHEMBL5534943 | 0.47 | — | — | |
| SCHEMBL2991373 | 0.46 | — | — | |
| SCHEMBL6324015 | 0.46 | — | — | |
| SCHEMBL5034193 | 0.45 | — | — | |
| SCHEMBL791275 | 0.41 | — | — | |
| SCHEMBL3675643 | 0.41 | — | — |
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-103509060-B | Metallocene compound, the carbon monoxide-olefin polymeric comprising metallocene compound and the olefine polymerizing process of use metallocene compound | 大林产业株式会社 | 2016-08-10 | — | — | CN | disclosed |