⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1345692 | 0.78 | — | — | |
| SCHEMBL8083742 | 0.71 | — | — | |
| SCHEMBL9176570 | 0.70 | — | — | |
| SCHEMBL8390469 | 0.70 | — | — | |
| SCHEMBL9408695 | 0.69 | — | — | |
| SCHEMBL3505346 | 0.69 | — | — | |
| SCHEMBL4163231 | 0.67 | — | — | |
| SCHEMBL1347204 | 0.67 | — | — | |
| SCHEMBL8979240 | 0.67 | — | — | |
| SCHEMBL8724057 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0618210-A1 | Process for preparation of beta-cyanoalkylsilanes using ruthenium catalyst | DOW CORNING CORPORATION (US) | 1994-10-05 | — | — | EP | disclosed |
| US-5312945-A | Process for preparation of β-cyanoalkylsilanes using ruthenium catalyst | DOW CORNING CORPORATION (US) | 1994-05-17 | — | — | US | disclosed |