⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23156866 | 1.00 | — | — | |
| SCHEMBL21948340 | 1.00 | — | — | |
| SCHEMBL8174840 | 1.00 | — | — | |
| SCHEMBL21216187 | 1.00 | — | — | |
| SCHEMBL14431963 | 1.00 | — | — | |
| SCHEMBL13335392 | 0.83 | — | — | |
| SCHEMBL3436808 | 0.83 | — | — | |
| SCHEMBL24802994 | 0.83 | — | — | |
| SCHEMBL13335395 | 0.83 | — | — | |
| SCHEMBL22880657 | 0.78 | NCF1 (0.33) | — |
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-3760632-B1 | PYRAZOLOPYRIMIDINE DERIVATIVE AND USE THEREOF | Simcere pharmaceutical co ltd (CN) | 2023-07-19 | — | — | EP | disclosed |