⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10279683 | 0.94 | TP53 (0.40) | — | |
| SCHEMBL10236428 | 0.93 | — | — | |
| SCHEMBL10237229 | 0.88 | RXFP1 (0.43) | — | |
| SCHEMBL10236423 | 0.85 | — | — | |
| SCHEMBL10236468 | 0.85 | — | — | |
| SCHEMBL10279055 | 0.81 | PTPN1 (0.54) | — | |
| SCHEMBL10236420 | 0.80 | — | — | |
| SCHEMBL10236447 | 0.80 | — | — | |
| SCHEMBL10279057 | 0.80 | — | — | |
| SCHEMBL10236425 | 0.80 | PTPN1 (0.40) | — |
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-8193372-B2 | Phosphothiophene and phosphothiazole HCV polymerase inhibitors | IDENIX PHARMACEUTICALS, INC. (US) | 2012-06-05 | — | — | US | disclosed |
| US-20100233123-A1 | PHOSPHOTHIOPHENE AND PHOSPHOTHIAZOLE HCV POLYMERASE INHIBITORS | IDENIX PHARMACEUTICALS, INC. (US) | 2010-09-16 | — | — | US | disclosed |