⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14679907 | 0.80 | — | — | |
| SCHEMBL25002994 | 0.69 | — | — | |
| SCHEMBL4550217 | 0.65 | — | — | |
| SCHEMBL14175334 | 0.65 | — | — | |
| SCHEMBL15726840 | 0.65 | — | — | |
| SCHEMBL25450490 | 0.65 | — | — | |
| SCHEMBL17854860 | 0.65 | — | — | |
| SCHEMBL24768080 | 0.63 | — | — | |
| SCHEMBL11932069 | 0.62 | — | — | |
| SCHEMBL22945561 | 0.61 | — | — |
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-11702422-B2 | Imidazopyridazines as modulators of IL-17 | JANSSEN PHARMACEUTICA NV (BE) | 2023-07-18 | — | — | US | disclosed |
| US-11034684-B2 | Isoxazole analogs as FXR agonists and methods of use thereof | ENANTA PHARMACEUTICALS, INC. (US) | 2021-06-15 | — | — | US | disclosed |