⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL198211 | 0.82 | — | — | |
| SCHEMBL21392929 | 0.79 | — | — | |
| SCHEMBL21256206 | 0.76 | — | — | |
| SCHEMBL325100 | 0.76 | — | — | |
| SCHEMBL194139 | 0.74 | — | — | |
| Water SCHEMBL10717161 | 0.70 | — | — | |
| SCHEMBL21116421 | 0.70 | — | — | |
| Iodide SCHEMBL27951208 | 0.70 | — | — | |
| SCHEMBL8024208 | 0.70 | — | — | |
| Bromide SCHEMBL27564189 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016053017-A1 | PROCESS FOR PREPARING ALPHA-SILYLAMINE COMPOUNDS FROM ALPHA-SILYLMETHYL AZIDE COMPOUNDS | 포항공과대학교 산학협력단 | 2016-04-07 | — | — | WO | disclosed |