⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10866789 | 0.62 | — | — | |
| SCHEMBL22302459 | 0.60 | — | — | |
| SCHEMBL4143888 | 0.59 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL122444 | 0.59 | — | — | |
| SCHEMBL8225205 | 0.59 | — | — | |
| SCHEMBL182957 | 0.59 | — | — | |
| SCHEMBL1244807 | 0.56 | — | — | |
| SCHEMBL12086845 | 0.55 | ALDH1A1 (0.32) | — | |
| SCHEMBL1108282 | 0.55 | KDM4E (0.40) | — | |
| SCHEMBL1244890 | 0.55 | TYR (0.40) | — |
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-1585481-A2 | PYRAZOLOPYRIMIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME | TANABE SEIYAKU CO., LTD. (JP) | 2005-10-19 | — | — | EP | disclosed |
| WO-2004064721-A2 | A PYRAZOLOPYRIMIDINE COMPOUND AND A PROCESS FOR PREPARING THE SAME | TANABE SEIYAKU CO., LTD. (JP) | 2004-08-05 | — | — | WO | disclosed |