⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6541862 | 0.64 | — | — | |
| SCHEMBL2671182 | 0.60 | ITGB2 (0.33) | — | |
| SCHEMBL7016696 | 0.59 | CDC25B (0.35) | — | |
| SCHEMBL19644130 | 0.58 | — | — | |
| SCHEMBL23460361 | 0.52 | — | — | |
| SCHEMBL6541014 | 0.52 | — | — | |
| SCHEMBL218741 | 0.52 | — | — | |
| SCHEMBL29765349 | 0.52 | — | — | |
| SCHEMBL29590064 | 0.51 | CDC25B (0.39) | — | |
| SCHEMBL16762620 | 0.50 | — | — |
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-1565475-A1 | DIAZINOPYRIMIDINES | F. HOFFMANN-LA ROCHE AG (CH) | 2005-08-24 | — | — | EP | disclosed |
| WO-2004046152-A1 | DIAZINOPYRIMIDINES | F. HOFFMANN LA ROCHE AG (CH) | 2004-06-03 | — | — | WO | disclosed |