⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13641840 | 0.69 | — | — | |
| SCHEMBL25400487 | 0.69 | — | — | |
| SCHEMBL1396031 | 0.67 | — | — | |
| SCHEMBL10696031 | 0.65 | — | — | |
| SCHEMBL727858 | 0.64 | — | — | |
| SCHEMBL10718003 | 0.64 | — | — | |
| SCHEMBL28810341 | 0.62 | — | — | |
| SCHEMBL6266414 | 0.62 | — | — | |
| SCHEMBL19926999 | 0.62 | ALDH1A1 (0.33) | — | |
| SCHEMBL16003927 | 0.60 | — | — |
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-113831433-B | Catalyst for olefin polymerization and olefin polymerization method | 中国石油化工股份有限公司 | 2023-01-03 | — | — | CN | disclosed |