⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1493268 | 0.92 | — | — | |
| SCHEMBL7055929 | 0.90 | ALOX5 (0.48) | — | |
| SCHEMBL3479376 | 0.85 | ALOX5 (0.62) | — | |
| SCHEMBL3479153 | 0.82 | ALOX5 (0.59) | — | |
| SCHEMBL7056951 | 0.82 | — | — | |
| SCHEMBL4157460 | 0.82 | ALOX5 (0.59) | — | |
| SCHEMBL3479692 | 0.82 | ALOX5 (0.59) | — | |
| SCHEMBL10824237 | 0.78 | ALOX5 (0.71) | — | |
| SCHEMBL11216419 | 0.78 | — | — | |
| SCHEMBL4937028 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1304325-A1 | 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-04-23 | — | — | EP | disclosed |