⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31497784 | 0.76 | — | — | |
| SCHEMBL17623509 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL31497769 | 0.68 | KMT2A (0.51) | — | |
| SCHEMBL24172246 | 0.67 | HSD11B1 (0.38) | — | |
| SCHEMBL31497780 | 0.67 | KDM4E (0.37) | — | |
| SCHEMBL21524358 | 0.67 | MAPK1 (0.32) | — | |
| SCHEMBL7941245 | 0.65 | ACHE (0.30) | — | |
| SCHEMBL19956192 | 0.64 | — | — | |
| SCHEMBL8788188 | 0.64 | — | — | |
| SCHEMBL13621435 | 0.64 | THRB (0.33) | — |
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-2025095021-A1 | TETRAZENE COMPOUND, TETRAZENE RADICAL SALT COMPOUND, TETRAZENE-TYPE ALCOHOL OXIDATION CATALYST, TETRAZENE RADICAL SALT-TYPE ALCOHOL OXIDATION CATALYST, AND ALCOHOL OXIDATION METHOD USING SAME | 国立大学法人東北大学 | 2025-05-08 | — | — | WO | disclosed |