⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL723878 | 0.76 | — | — | |
| SCHEMBL15096844 | 0.74 | — | — | |
| SCHEMBL721366 | 0.66 | — | — | |
| SCHEMBL4424282 | 0.64 | — | — | |
| SCHEMBL2870230 | 0.64 | — | — | |
| SCHEMBL12678052 | 0.64 | — | — | |
| SCHEMBL12617560 | 0.64 | — | — | |
| SCHEMBL12124087 | 0.64 | — | — | |
| SCHEMBL236802 | 0.64 | — | — | |
| SCHEMBL562805 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20030065117-A1 | Modified silicone compound, process of producing the same, and cured object obtained therefrom | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2003-04-03 | — | — | US | disclosed |