⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20079351 | 0.80 | — | — | |
| SCHEMBL3096553 | 0.76 | — | — | |
| SCHEMBL1059665 | 0.76 | — | — | |
| SCHEMBL1767175 | 0.71 | — | — | |
| SCHEMBL24719070 | 0.71 | — | — | |
| SCHEMBL781773 | 0.71 | MME (0.30) | — | |
| SCHEMBL23578 | 0.69 | — | — | |
| SCHEMBL4622226 | 0.67 | — | — | |
| SCHEMBL9676418 | 0.67 | — | — | |
| SCHEMBL23519998 | 0.65 | — | — |
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-3178818-A1 | PYRAZOLYL QUINOXALINE KINASE INHIBITORS | Astex Therapeutics Limited (GB) | 2017-06-14 | — | — | EP | disclosed |
| US-20080038768-A1 | Assay for ubiquitin mediated proteolysis | FILIPUZZI IREOS | 2008-02-14 | — | — | US | disclosed |