⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20912526 | 0.97 | — | — | |
| SCHEMBL20912531 | 0.97 | — | — | |
| SCHEMBL5650143 | 0.93 | ESR1 (0.31) | — | |
| SCHEMBL5647074 | 0.89 | ESR1 (0.33) | — | |
| SCHEMBL14870533 | 0.85 | — | — | |
| SCHEMBL12680906 | 0.85 | — | — | |
| SCHEMBL6414974 | 0.85 | — | — | |
| SCHEMBL12680910 | 0.84 | — | — | |
| SCHEMBL19220473 | 0.84 | — | — | |
| SCHEMBL17704577 | 0.83 | ESR1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111825710-B | Alkoxysilyl group-containing organosilane compound, method for producing same, composition containing same, and cured product | 信越化学工业株式会社 | 2024-08-23 | — | — | CN | disclosed |
| CN-111825710-A | Organosilazane compounds containing alkoxysilyl groups, process for their preparation, compositions containing them and cured products | 信越化学工业株式会社 | 2020-10-27 | — | — | CN | disclosed |