⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9194830 | 0.83 | — | — | |
| Uric Acid SCHEMBL3325279 | 0.77 | — | — | |
| SCHEMBL9443846 | 0.74 | NUDT1 (0.39) | — | |
| SCHEMBL7672758 | 0.74 | PNP (0.48) | — | |
| SCHEMBL612166 | 0.71 | ADORA2A (0.35) | — | |
| SCHEMBL4110072 | 0.62 | — | — | |
| Xanthine SCHEMBL4966 | 0.61 | GDA (0.44) | — | |
| SCHEMBL27772762 | 0.57 | — | — | |
| SCHEMBL25200325 | 0.56 | AURKA (0.38) | — | |
| SCHEMBL6016629 | 0.56 | EGLN1 (0.43) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5213972-A | Production of thymidine and deoxyuridine, intermediates for AZT | CHEMGEN CORPORATION (US) | 1993-05-25 | — | — | US | disclosed |
| WO-1992020816-A1 | DETERMINATION OF PRODRUGS METABOLIZABLE BY THE LIVER AND THERAPEUTIC USE THEREOF | YALE UNIVERSITY (US) | 1992-11-26 | — | — | WO | disclosed |