⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23256048 | 0.70 | — | — | |
| SCHEMBL12834826 | 0.70 | — | — | |
| SCHEMBL14507856 | 0.65 | — | — | |
| SCHEMBL22701776 | 0.65 | — | — | |
| SCHEMBL23517359 | 0.64 | — | — | |
| SCHEMBL21032710 | 0.62 | — | — | |
| SCHEMBL24581227 | 0.61 | — | — | |
| SCHEMBL20419015 | 0.61 | — | — | |
| SCHEMBL13465181 | 0.59 | — | — | |
| SCHEMBL28081741 | 0.59 | — | — |
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-3517112-B1 | HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF SUMO ACTIVATING ENZYME | MILLENNIUM PHARM INC (US) | 2021-04-07 | — | — | EP | disclosed |