⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13856021 | 1.00 | — | — | |
| SCHEMBL13856063 | 0.78 | — | — | |
| SCHEMBL13856073 | 0.72 | — | — | |
| SCHEMBL14204553 | 0.71 | — | — | |
| SCHEMBL13856050 | 0.70 | — | — | |
| SCHEMBL13492001 | 0.69 | — | — | |
| SCHEMBL10259533 | 0.69 | — | — | |
| SCHEMBL17483746 | 0.67 | — | — | |
| SCHEMBL2632834 | 0.67 | — | — | |
| SCHEMBL9906775 | 0.67 | — | — |
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-20220402922-A1 | IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 | JANSSEN RESEARCH & DEVELOPMENT, LLC | 2022-12-22 | — | — | US | disclosed |