⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28735214 | 0.78 | — | — | |
| SCHEMBL5035138 | 0.77 | — | — | |
| SCHEMBL16940588 | 0.77 | — | — | |
| SCHEMBL16218844 | 0.75 | — | — | |
| SCHEMBL13419040 | 0.75 | — | — | |
| SCHEMBL29991647 | 0.75 | — | — | |
| SCHEMBL16225018 | 0.74 | — | — | |
| SCHEMBL12769253 | 0.74 | — | — | |
| SCHEMBL12769962 | 0.74 | — | — | |
| SCHEMBL19119092 | 0.74 | — | — |
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-3037409-A1 | BIMETALLIC CATALYST FOR OLEFIN POLYMERIZATION | Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) | 2016-06-29 | — | — | EP | disclosed |