⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14124526 | 0.97 | — | — | |
| SCHEMBL14124528 | 0.84 | — | — | |
| SCHEMBL17482162 | 0.84 | — | — | |
| SCHEMBL11243113 | 0.73 | — | — | |
| SCHEMBL20778585 | 0.67 | — | — | |
| SCHEMBL14699732 | 0.65 | L3MBTL1 (0.43) | — | |
| SCHEMBL77166 | 0.62 | LMNA (0.30) | — | |
| SCHEMBL10908775 | 0.59 | — | — | |
| SCHEMBL7977161 | 0.59 | — | — | |
| SCHEMBL2517676 | 0.59 | — | — |
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-7399841-B1 | High-energy 1,3,5-triazinyl diazenes, and process thereof | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2008-07-15 | — | — | US | disclosed |