⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28537658 | 0.77 | — | — | |
| SCHEMBL28535024 | 0.76 | — | — | |
| SCHEMBL8463789 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL28910778 | 0.69 | — | — | |
| SCHEMBL30558085 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL8467734 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL11761309 | 0.64 | — | — | |
| SCHEMBL6255498 | 0.64 | — | — | |
| SCHEMBL12657953 | 0.63 | — | — | |
| SCHEMBL10783418 | 0.61 | ODC1 (0.32) | — |
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-107406467-B | Polyvinylaminosilanes as branching agents for functionalized elastomeric polymers | 盛禧奥欧洲有限责任公司 | 2020-11-10 | — | — | CN | disclosed |