⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21496039 | 0.85 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL615128 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL27788284 | 0.70 | — | — | |
| SCHEMBL28017309 | 0.70 | — | — | |
| SCHEMBL6469803 | 0.68 | — | — | |
| SCHEMBL23599207 | 0.67 | — | — | |
| SCHEMBL2007452 | 0.67 | — | — | |
| SCHEMBL4715 | 0.67 | — | — | |
| SCHEMBL22444413 | 0.67 | — | — | |
| SCHEMBL13698656 | 0.67 | — | — |
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-111989333-B | Organosilicon compound and method for producing same | 信越化学工业株式会社 | 2023-09-15 | — | — | CN | disclosed |