⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL729122 | 0.89 | KDM4E (0.32) | — | |
| SCHEMBL2981943 | 0.89 | KDM4E (0.32) | — | |
| SCHEMBL9651 | 0.89 | KDM4E (0.32) | — | |
| SCHEMBL21840732 | 0.89 | KDM4E (0.32) | — | |
| SCHEMBL9160578 | 0.85 | KDM4E (0.31) | — | |
| Bromide SCHEMBL30274207 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL28353015 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL17162156 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL28872386 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL5481375 | 0.81 | — | — |
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-2004056836-A1 | SILICON-CONTAINING COMPOUNDS AND THEIR USE | AMEDIS PHARMACEUTICALS LTD. (GB) | 2004-07-08 | — | — | WO | disclosed |