⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL707861 | 0.72 | — | — | |
| SCHEMBL707862 | 0.72 | — | — | |
| SCHEMBL1059082 | 0.71 | — | — | |
| SCHEMBL7814020 | 0.71 | — | — | |
| SCHEMBL1059084 | 0.71 | — | — | |
| SCHEMBL11070095 | 0.71 | — | — | |
| SCHEMBL14714477 | 0.70 | — | — | |
| SCHEMBL14714476 | 0.70 | — | — | |
| SCHEMBL6109225 | 0.70 | — | — | |
| SCHEMBL11005629 | 0.69 | KDM4E (0.36) | — |
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 |