⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10183382 | 0.81 | — | — | |
| SCHEMBL10183389 | 0.79 | PI4KA (0.36) | — | |
| SCHEMBL18026285 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL10149432 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL10183346 | 0.66 | PI4KA (0.36) | — | |
| SCHEMBL10183384 | 0.65 | PI4KA (0.35) | — | |
| SCHEMBL18009907 | 0.63 | ALDH1A1 (0.31) | — | |
| SCHEMBL31526249 | 0.62 | PI4KA (0.38) | — | |
| SCHEMBL14154548 | 0.61 | PI4KA (0.35) | — | |
| SCHEMBL29420121 | 0.61 | PI4KA (0.35) | — |
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-20120077814-A1 | SULFONAMIDE, SULFAMATE, AND SULFAMOTHIOATE DERIVATIVES | WANG ZHONG (US) | 2012-03-29 | — | — | US | disclosed |