⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4096961 | 0.74 | — | — | |
| SCHEMBL29502628 | 0.74 | HSD11B1 (0.37) | — | |
| SCHEMBL19264995 | 0.73 | — | — | |
| SCHEMBL29437748 | 0.73 | — | — | |
| SCHEMBL30728592 | 0.69 | — | — | |
| SCHEMBL8760979 | 0.68 | — | — | |
| SCHEMBL31381391 | 0.68 | — | — | |
| SCHEMBL746990 | 0.63 | — | — | |
| SCHEMBL10884198 | 0.63 | ALDH1A1 (0.30) | — | |
| SCHEMBL28370555 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105189453-B | Sulfamoyl aryl amide and its purposes as the medicine for treating hepatitis B | 爱尔兰詹森科学公司 | 2018-04-10 | — | — | CN | disclosed |