⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL203581 | 0.82 | — | — | |
| SCHEMBL203994 | 0.78 | — | — | |
| SCHEMBL202999 | 0.75 | — | — | |
| SCHEMBL203923 | 0.75 | AKT1 (0.33) | — | |
| SCHEMBL204025 | 0.75 | MAPT (0.35) | — | |
| SCHEMBL203092 | 0.75 | PSMB8 (0.37) | — | |
| SCHEMBL204109 | 0.73 | — | — | |
| SCHEMBL202731 | 0.72 | — | — | |
| SCHEMBL203481 | 0.71 | APP (0.35) | — | |
| SCHEMBL203036 | 0.71 | PSMB8 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2155699-A1 | ARYLOAZOL-2-YL CYANOETHYLAMINO COMPOUNDS, METHOD OF MAKING AND METHOD OF USING THEREOF | Merial Limited (US) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008144275-A1 | ARYLOAZOL-2-YL CYANOETHYLAMINO COMPOUNDS, METHOD OF MAKING AND METHOD OF USING THEREOF | MERIAL LIMITED (US) | 2008-11-27 | — | — | WO | disclosed |