⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4628375 | 0.92 | — | — | |
| SCHEMBL4627377 | 0.92 | — | — | |
| SCHEMBL4624952 | 0.91 | — | — | |
| SCHEMBL4628007 | 0.90 | — | — | |
| SCHEMBL4626613 | 0.90 | — | — | |
| SCHEMBL4626956 | 0.89 | — | — | |
| SCHEMBL4625288 | 0.89 | — | — | |
| SCHEMBL4626172 | 0.89 | — | — | |
| SCHEMBL4627761 | 0.89 | — | — | |
| SCHEMBL4627011 | 0.88 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1456217-B1 | METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM | EXXONMOBIL CHEM PATENTS INC (US) | 2008-02-13 | — | — | EP | disclosed |