⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16699384 | 0.86 | ALDH1A1 (0.33) | — | |
| SCHEMBL19779083 | 0.84 | POLRMT (0.35) | — | |
| SCHEMBL19779236 | 0.84 | CYP3A4 (0.34) | — | |
| SCHEMBL25273849 | 0.79 | — | — | |
| SCHEMBL23042853 | 0.75 | ADORA3 (0.36) | — | |
| SCHEMBL22899527 | 0.73 | — | — | |
| SCHEMBL22899530 | 0.73 | NT5E (0.32) | — | |
| SCHEMBL25220869 | 0.72 | — | — | |
| SCHEMBL16710860 | 0.72 | TMPRSS2 (0.38) | — | |
| SCHEMBL26832567 | 0.71 | TMPRSS2 (0.37) | — |
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-4192839-A1 | REMDESIVIR INTERMEDIATES | Richter Gedeon Nyrt. (HU) | 2023-06-14 | — | — | EP | disclosed |