⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31661378 | 0.88 | — | — | |
| Trifluoroacetic Acid SCHEMBL1583657 | 0.72 | DPP8 (0.32) | — | |
| SCHEMBL6746178 | 0.71 | — | — | |
| Trifluoroacetic Acid SCHEMBL1583695 | 0.70 | — | — | |
| SCHEMBL19834983 | 0.69 | ACE (0.33) | — | |
| SCHEMBL1015148 | 0.69 | PPM1D (0.32) | — | |
| SCHEMBL2794681 | 0.69 | PPM1D (0.32) | — | |
| SCHEMBL7442762 | 0.69 | PPM1D (0.32) | — | |
| SCHEMBL2789186 | 0.69 | PPM1D (0.32) | — | |
| SCHEMBL1015150 | 0.69 | PPM1D (0.32) | — |
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-2025149623-A1 | WNK1 INHIBITORS | DANIA THERAPEUTICS APS (DK) | 2025-07-17 | — | — | WO | disclosed |