⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20061207 | 0.86 | KDM4E (0.37) | — | |
| SCHEMBL5582435 | 0.83 | — | — | |
| SCHEMBL14460147 | 0.83 | — | — | |
| SCHEMBL18202490 | 0.77 | GRM5 (0.30) | — | |
| SCHEMBL4963603 | 0.76 | CTSA (0.34) | — | |
| SCHEMBL12300764 | 0.76 | KDM4E (0.33) | — | |
| SCHEMBL12300762 | 0.71 | KDM4E (0.32) | — | |
| SCHEMBL20061199 | 0.70 | KDM4E (0.36) | — | |
| SCHEMBL5582388 | 0.66 | — | — | |
| SCHEMBL20065595 | 0.65 | CTSA (0.34) | — |
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-2980095-A1 | PHOSPONATE NUCLEOSIDES USEFUL AS ACTIVE INGREDIENTS IN PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS, AND INTERMEDIATES FOR THEIR PRODUCTION | K.U.Leuven Research & Development (BE) | 2016-02-03 | — | — | EP | disclosed |