⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30281179 | 0.86 | — | — | |
| SCHEMBL28976609 | 0.84 | TEAD1 (0.36) | — | |
| SCHEMBL30281268 | 0.75 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL29252887 | 0.71 | KDM1A (0.34) | — | |
| SCHEMBL2186183 | 0.70 | ALDH1A1 (0.35) | — | |
| SCHEMBL30281113 | 0.62 | NPC1 (0.35) | — | |
| SCHEMBL25431739 | 0.62 | TRPV4 (0.31) | — | |
| SCHEMBL1018048 | 0.62 | HSD11B1 (0.43) | — | |
| SCHEMBL24215686 | 0.62 | HCAR2 (0.37) | — | |
| SCHEMBL22207600 | 0.61 | MAPT (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 |
|---|---|---|---|---|---|---|---|
| EP-4143195-A1 | IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 | Janssen Pharmaceutica NV (BE) | 2023-03-08 | — | — | EP | disclosed |