⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL116944 | 0.91 | — | — | |
| SCHEMBL30973629 | 0.89 | — | — | |
| Acetone SCHEMBL6898104 | 0.86 | HTT (0.33) | — | |
| SCHEMBL394834 | 0.84 | — | — | |
| SCHEMBL29497620 | 0.84 | — | — | |
| SCHEMBL29907880 | 0.84 | — | — | |
| SCHEMBL3021204 | 0.83 | — | — | |
| SCHEMBL3022283 | 0.83 | — | — | |
| SCHEMBL3117464 | 0.83 | — | — | |
| SCHEMBL7460569 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7005398-B2 | Olefin polymerization catalyst, catalyst component for olefin polymerization, method of storing these, and process for producing olefin polymer | SUNALLOMER LTD. (JP) | 2006-02-28 | — | — | US | disclosed |