⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5735865 | 1.00 | — | — | |
| SCHEMBL2970137 | 1.00 | — | — | |
| SCHEMBL6885275 | 0.94 | ALDH1A1 (0.30) | — | |
| SCHEMBL103207 | 0.94 | ALDH1A1 (0.30) | — | |
| SCHEMBL9282863 | 0.89 | — | — | |
| Bromide SCHEMBL8603205 | 0.89 | — | — | |
| Bromide SCHEMBL22719811 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL22719817 | 0.89 | — | — | |
| SCHEMBL11575313 | 0.89 | — | — | |
| SCHEMBL14806850 | 0.89 | — | — |
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-1155057-B1 | IN MOLD ADDITION POLYMERIZATION OF NORBORNENE-TYPE MONOMERS USING GROUP 10 METAL COMPLEXES | SUMITOMO BAKELITE CO (JP) | 2005-06-22 | — | — | EP | claimed |