⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30281156 | 0.86 | — | — | |
| SCHEMBL29252887 | 0.85 | KDM1A (0.34) | — | |
| SCHEMBL28976609 | 0.71 | TEAD1 (0.36) | — | |
| SCHEMBL28917325 | 0.64 | KDM4E (0.50) | — | |
| SCHEMBL26053111 | 0.64 | — | — | |
| SCHEMBL25211561 | 0.62 | — | — | |
| SCHEMBL30526884 | 0.61 | PARP1 (0.44) | — | |
| SCHEMBL30281268 | 0.61 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL25371391 | 0.61 | TDP1 (0.30) | — | |
| SCHEMBL29241719 | 0.61 | KDM4E (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 |
|---|---|---|---|---|---|---|---|
| EP-4143195-A1 | IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 | Janssen Pharmaceutica NV (BE) | 2023-03-08 | — | — | EP | disclosed |