⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25860762 | 0.81 | CCNE1 (0.32) | — | |
| SCHEMBL24770546 | 0.79 | — | — | |
| SCHEMBL25895105 | 0.79 | TOP2A (0.39) | — | |
| SCHEMBL23985483 | 0.78 | — | — | |
| SCHEMBL25864821 | 0.76 | TOP2A (0.30) | — | |
| SCHEMBL25464324 | 0.75 | HCRTR1 (0.34) | — | |
| SCHEMBL10274589 | 0.74 | — | — | |
| SCHEMBL25688409 | 0.74 | — | — | |
| SCHEMBL24769771 | 0.73 | TDP1 (0.33) | — | |
| Bromide SCHEMBL6855980 | 0.72 | CHRM2 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11691979-B2 | Imidazopyridazines as modulators of IL-17 | JANSSEN PHARMACEUTICA NV (BE) | 2023-07-04 | — | — | US | disclosed |
| US-20220402922-A1 | IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 | JANSSEN RESEARCH & DEVELOPMENT, LLC | 2022-12-22 | — | — | US | disclosed |