⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22525942 | 0.70 | — | — | |
| SCHEMBL12186514 | 0.70 | — | — | |
| SCHEMBL12152657 | 0.67 | — | — | |
| SCHEMBL7421619 | 0.66 | PDE4A (0.30) | — | |
| SCHEMBL8856065 | 0.59 | — | — | |
| SCHEMBL22810042 | 0.55 | — | — | |
| SCHEMBL13050461 | 0.54 | TYMS (0.32) | — | |
| SCHEMBL14731219 | 0.51 | — | — | |
| SCHEMBL12651567 | 0.51 | PNMT (0.36) | — | |
| SCHEMBL16181722 | 0.51 | — | — |
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-3486244-A1 | NEW COMPOUND HAVING FGFR INHIBITORY ACTIVITY AND PREPARATION AND APPLICATION THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2019-05-22 | — | — | EP | disclosed |