⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13714846 | 0.74 | — | — | |
| SCHEMBL6004558 | 0.71 | — | — | |
| SCHEMBL6004458 | 0.68 | — | — | |
| SCHEMBL9254732 | 0.65 | MAPK1 (0.46) | — | |
| SCHEMBL2719334 | 0.64 | PGK1 (0.39) | — | |
| SCHEMBL5935161 | 0.64 | PGK1 (0.39) | — | |
| SCHEMBL3647152 | 0.64 | PGK1 (0.39) | — | |
| SCHEMBL21121892 | 0.64 | SMPD1 (0.30) | — | |
| SCHEMBL839514 | 0.63 | MAPK1 (0.46) | — | |
| SCHEMBL639689 | 0.63 | MAPK1 (0.46) | — |
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-20060252729-A1 | Nucleobase phosphonate analogs for antiviral treatment | GILEAD SCIENCES, INC. | 2006-11-09 | — | — | US | disclosed |