⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20929389 | 0.77 | — | — | |
| SCHEMBL799824 | 0.77 | — | — | |
| SCHEMBL28579490 | 0.75 | DRD2 (0.32) | — | |
| SCHEMBL28579567 | 0.74 | — | — | |
| SCHEMBL21658538 | 0.69 | — | — | |
| SCHEMBL8334578 | 0.65 | — | — | |
| SCHEMBL18912354 | 0.65 | ALDH1A1 (0.35) | — | |
| SCHEMBL24832725 | 0.62 | — | — | |
| SCHEMBL20284616 | 0.62 | — | — | |
| SCHEMBL24632600 | 0.62 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109415447-B | Silane-mediated enhancement of rubber storage stability | 盛禧奥欧洲有限责任公司 | 2021-06-15 | — | — | CN | disclosed |
| CN-105683203-A | VINYLSILANES FOR USE IN FUNCTIONALIZED ELASTOMERIC POLYMERS | 盛禧奥欧洲有限责任公司 | 2016-06-15 | — | — | CN | disclosed |