⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8538774 | 0.90 | — | — | |
| SCHEMBL8537108 | 0.85 | — | — | |
| SCHEMBL3103142 | 0.75 | — | — | |
| SCHEMBL8536894 | 0.73 | — | — | |
| SCHEMBL7600576 | 0.73 | — | — | |
| SCHEMBL227007 | 0.71 | SPHK2 (0.32) | — | |
| SCHEMBL230813 | 0.71 | SPHK2 (0.32) | — | |
| SCHEMBL4855026 | 0.70 | — | — | |
| SCHEMBL229967 | 0.69 | — | — | |
| SCHEMBL9845139 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0795558-B1 | Process for the preparation of polysulfidic silylethers | BAYER AG (DE) | 2002-09-04 | — | — | EP | disclosed |
| EP-0795558-A1 | Process for the preparation of polysulfidic silylethers | BAYER AG (DE) | 1997-09-17 | — | — | EP | disclosed |