⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12157226 | 0.91 | — | — | |
| SCHEMBL16378893 | 0.91 | — | — | |
| SCHEMBL17282320 | 0.86 | FUCA1 (0.61) | — | |
| SCHEMBL8505259 | 0.86 | FUCA1 (0.61) | — | |
| SCHEMBL16522565 | 0.86 | FUCA1 (0.61) | — | |
| SCHEMBL16526373 | 0.86 | FUCA1 (0.61) | — | |
| SCHEMBL16522590 | 0.86 | FUCA1 (0.61) | — | |
| SCHEMBL16526379 | 0.86 | FUCA1 (0.61) | — | |
| SCHEMBL18940367 | 0.86 | FUCA1 (0.61) | — | |
| SCHEMBL19522642 | 0.86 | FUCA1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230203044-A1 | PYRAZOLO[1,5-D][1,2,4]TRIAZINE-5(4H)-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME | JANSSEN PHARMACEUTICA NV (BE) | 2023-06-29 | — | — | US | disclosed |