⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6725151 | 1.00 | — | — | |
| SCHEMBL25260677 | 1.00 | — | — | |
| SCHEMBL10900674 | 0.80 | CYP2D6 (0.58) | — | |
| SCHEMBL6725146 | 0.79 | — | — | |
| SCHEMBL30983887 | 0.79 | — | — | |
| SCHEMBL6720564 | 0.78 | — | — | |
| SCHEMBL402167 | 0.78 | — | — | |
| SCHEMBL21359205 | 0.78 | CYP2D6 (0.70) | — | |
| SCHEMBL26506249 | 0.77 | CYP2C19 (0.37) | — | |
| SCHEMBL6728519 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230331719-A1 | Pyrazolopyridine Compounds and Methods of Inhibiting IRE1 Using Same | OPTIKIRA LLC (US) | 2023-10-19 | — | — | US | disclosed |
| EP-4192462-A1 | PYRAZOLOPYRIDINE COMPOUNDS AND METHODS OF INHIBITING IRE1 USING SAME | Optikira LLC (US) | 2023-06-14 | — | — | EP | disclosed |