⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20761815 | 0.92 | ALDH1A1 (0.48) | — | |
| SCHEMBL20196176 | 0.83 | — | — | |
| SCHEMBL18602949 | 0.69 | — | — | |
| SCHEMBL118515 | 0.69 | — | — | |
| SCHEMBL1290871 | 0.65 | ALDH1A1 (0.75) | — | |
| SCHEMBL21216 | 0.65 | ALDH1A1 (0.91) | — | |
| SCHEMBL212626 | 0.65 | — | — | |
| SCHEMBL25775736 | 0.65 | — | — | |
| SCHEMBL11938156 | 0.65 | CA12 (0.44) | — | |
| Dimethyl Sulfoxide SCHEMBL28124702 | 0.64 | CA12 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019034696-A1 | NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS | INFLAZOME LIMITED (IE) | 2019-02-21 | — | — | WO | disclosed |