⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL899953 | 0.81 | ALDH1A1 (0.36) | — | |
| Ether SCHEMBL16566504 | 0.70 | — | — | |
| SCHEMBL1032872 | 0.69 | CA1 (0.40) | — | |
| SCHEMBL30952527 | 0.69 | CA1 (0.40) | — | |
| Ether SCHEMBL8081994 | 0.67 | — | — | |
| SCHEMBL8390342 | 0.67 | HTT (0.41) | — | |
| SCHEMBL5513285 | 0.67 | ALDH1A1 (0.36) | — | |
| SCHEMBL30688718 | 0.67 | ALDH1A1 (0.36) | — | |
| SCHEMBL28892566 | 0.66 | ALDH1A1 (0.32) | — | |
| SCHEMBL5952271 | 0.65 | MAPT (0.48) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4515912-A | REINFORCED POLYEPOXIDE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1985-05-07 | — | — | US | claimed |
| US-4943610-A | Non-shrinking, dimensionally-stable modified epoxy resins | UNITED STATES OF AMERICA, THE, AS REPRESENTED BY THE SECRETARY OF THE ARMY | 1990-07-24 | — | — | US | disclosed |
| US-4515912-A | REINFORCED POLYEPOXIDE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1985-05-07 | — | — | US | disclosed |