⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6240203 | 0.76 | — | — | |
| SCHEMBL8631544 | 0.76 | — | — | |
| SCHEMBL465672 | 0.66 | — | — | |
| SCHEMBL5872408 | 0.64 | — | — | |
| SCHEMBL2136863 | 0.57 | — | — | |
| SCHEMBL4036743 | 0.54 | — | — | |
| SCHEMBL2141595 | 0.53 | — | — | |
| SCHEMBL11077251 | 0.51 | — | — | |
| SCHEMBL2029571 | 0.50 | — | — | |
| SCHEMBL251182 | 0.49 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4476337-A | Method for introducing fluorine into an aromatic ring | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1984-10-09 | — | — | US | disclosed |
| US-4423260-A | Method for introducing fluorine into an aromatic ring | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1983-12-27 | — | — | US | disclosed |