⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL821227 | 0.67 | — | — | |
| Creatinine SCHEMBL27583566 | 0.64 | — | — | |
| Creatinine SCHEMBL5904293 | 0.64 | — | — | |
| SCHEMBL9336470 | 0.62 | — | — | |
| SCHEMBL3068428 | 0.62 | — | — | |
| SCHEMBL3499897 | 0.59 | — | — | |
| SCHEMBL17704772 | 0.59 | — | — | |
| SCHEMBL9422395 | 0.59 | — | — | |
| SCHEMBL10709770 | 0.57 | CRBN (0.33) | — | |
| SCHEMBL18766781 | 0.57 | — | — |
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-2371825-A1 | Process for the synthesis of azacitidine and decitabine | Chemi SPA (IT) | 2011-10-05 | — | — | EP | disclosed |