⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4363534 | 0.88 | NR1I2 (0.37) | — | |
| SCHEMBL2611991 | 0.88 | NR1I2 (0.37) | — | |
| SCHEMBL4368734 | 0.88 | NR1I2 (0.37) | — | |
| SCHEMBL10249905 | 0.78 | — | — | |
| SCHEMBL10247706 | 0.77 | — | — | |
| SCHEMBL2105295 | 0.74 | NR1I2 (0.41) | — | |
| SCHEMBL2105487 | 0.74 | NR1I2 (0.41) | — | |
| SCHEMBL2105297 | 0.74 | NR1I2 (0.41) | — | |
| SCHEMBL2106524 | 0.74 | NR1I2 (0.41) | — | |
| SCHEMBL2105482 | 0.74 | NR1I2 (0.41) | — |
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-1879879-B1 | COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS | VIROCHEM PHARMA INC (CA) | 2013-03-27 | — | — | EP | disclosed |