⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12629940 | 0.80 | — | — | |
| SCHEMBL16215316 | 0.80 | — | — | |
| SCHEMBL12561441 | 0.73 | — | — | |
| SCHEMBL8554213 | 0.62 | — | — | |
| SCHEMBL22666414 | 0.62 | — | — | |
| SCHEMBL21754826 | 0.59 | SPHK2 (0.34) | — | |
| SCHEMBL21557050 | 0.57 | — | — | |
| SCHEMBL2769789 | 0.55 | — | — | |
| SCHEMBL21894782 | 0.54 | — | — | |
| SCHEMBL14747279 | 0.53 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10570112-B2 | Synthetic intermediate of 1-(2-deoxy-2-fluoro-4-thio-β-D-arabinofuranosyl)cytosine, synthetic intermediate of thionucleoside, and method for producing the same | FUJIFILM CORPORATION (JP) | 2020-02-25 | — | — | US | disclosed |