⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8761117 | 0.90 | UPP1 (0.36) | — | |
| SCHEMBL9354282 | 0.79 | DUT (0.39) | — | |
| SCHEMBL9353754 | 0.76 | MAPK1 (0.41) | — | |
| SCHEMBL7534620 | 0.76 | UPP1 (0.35) | — | |
| SCHEMBL9353914 | 0.70 | SIRT2 (0.37) | — | |
| SCHEMBL7534083 | 0.70 | DUT (0.56) | — | |
| SCHEMBL9353732 | 0.70 | SIRT2 (0.37) | — | |
| SCHEMBL7541951 | 0.69 | UPP1 (0.46) | — | |
| SCHEMBL9357392 | 0.67 | ALDH1A1 (0.34) | — | |
| SCHEMBL8760912 | 0.66 | ALDH1A1 (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0449726-B1 | Pyrimidine nucleoside derivative and antiviral agent containing the derivative as active ingredient | MITSUBISHI CHEM CORP (JP) | 1997-06-11 | — | — | EP | disclosed |
| US-5318972-A | Active against retroviruses, human t-cell leukemia/lymphoma viruses | MITSUBISHI KASEI CORPORATION (JP) | 1994-06-07 | — | — | US | disclosed |
| EP-0449726-A1 | Pyrimidine nucleoside derivative and antiviral agent containing the derivative as active ingredient | Mitsubishi Chemical Corporation (JP) | 1991-10-02 | — | — | EP | disclosed |