⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9410857 | 0.82 | — | — | |
| SCHEMBL9187305 | 0.82 | — | — | |
| SCHEMBL9185745 | 0.82 | — | — | |
| SCHEMBL9183129 | 0.82 | — | — | |
| SCHEMBL65859 | 0.81 | — | — | |
| SCHEMBL31441089 | 0.80 | — | — | |
| SCHEMBL21630825 | 0.78 | — | — | |
| SCHEMBL1629482 | 0.78 | — | — | |
| SCHEMBL63112 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL27766991 | 0.78 | — | — |
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-0624591-A1 | Organosilicon compounds with cage structure | Wacker-Chemie GmbH (DE) | 1994-11-17 | — | — | EP | disclosed |