⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13758717 | 0.90 | — | — | |
| SCHEMBL10247696 | 0.88 | — | — | |
| SCHEMBL13758704 | 0.88 | — | — | |
| SCHEMBL13758886 | 0.87 | — | — | |
| SCHEMBL13758726 | 0.85 | — | — | |
| SCHEMBL2619765 | 0.85 | OPRD1 (0.32) | — | |
| SCHEMBL14549361 | 0.85 | — | — | |
| SCHEMBL13758867 | 0.84 | — | — | |
| SCHEMBL14818405 | 0.83 | SLC6A2 (0.32) | — | |
| SCHEMBL13758736 | 0.83 | POLB (0.33) | — |
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-7569600-B2 | Compounds and methods for the treatment of prevention of Flavivirus infections | VIROCHEM PHARMA INC. (CA) | 2009-08-04 | — | — | US | disclosed |