⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23843837 | 0.80 | — | — | |
| SCHEMBL19258518 | 0.69 | — | — | |
| SCHEMBL3646304 | 0.63 | — | — | |
| SCHEMBL4353326 | 0.59 | — | — | |
| Butane SCHEMBL9423505 | 0.58 | — | — | |
| SCHEMBL4354446 | 0.58 | — | — | |
| SCHEMBL911171 | 0.57 | — | — | |
| SCHEMBL4350624 | 0.56 | CYP1A2 (0.36) | — | |
| SCHEMBL23015412 | 0.56 | — | — | |
| Alcohol SCHEMBL14720567 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2845857-A1 | Use of cyclohexa-2,5-dien-1-yl-silanes as precursors for gaseous hydrosilanes | Technische Universität Berlin (DE) | 2015-03-11 | — | — | EP | disclosed |