⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3898599 | 0.79 | — | — | |
| SCHEMBL6858305 | 0.73 | — | — | |
| SCHEMBL19873368 | 0.73 | — | — | |
| SCHEMBL1663129 | 0.69 | — | — | |
| SCHEMBL8082956 | 0.67 | — | — | |
| SCHEMBL1244046 | 0.67 | — | — | |
| SCHEMBL103565 | 0.67 | — | — | |
| SCHEMBL7902749 | 0.67 | — | — | |
| SCHEMBL19873371 | 0.67 | GRM5 (0.33) | — | |
| SCHEMBL5639148 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117980297-A | Substituted aminopyridine compounds as EGFR inhibitors | 柳韩洋行 | 2024-05-03 | — | — | CN | disclosed |
| WO-2010063487-A1 | PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE | MERZ PHARMA GMBH & CO. KGAA (DE) | 2010-06-10 | — | — | WO | disclosed |