⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3628864 | 0.52 | — | — | |
| SCHEMBL6444424 | 0.52 | — | — | |
| SCHEMBL31590672 | 0.52 | — | — | |
| SCHEMBL3096575 | 0.52 | — | — | |
| SCHEMBL1690082 | 0.47 | — | — | |
| SCHEMBL3349940 | 0.43 | — | — | |
| SCHEMBL31070934 | 0.37 | — | — | |
| SCHEMBL1190870 | 0.34 | — | — | |
| Iodide SCHEMBL489610 | 0.32 | — | — | |
| SCHEMBL3936458 | 0.30 | — | — |
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-2475657-A1 | INHIBITORS OF FLAVIVIRIDAE VIRUSES | Gilead Sciences, Inc. (US) | 2012-07-18 | — | — | EP | disclosed |