⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL410733 | 0.75 | — | — | |
| Pivalamide SCHEMBL2484 | 0.75 | — | — | |
| SCHEMBL845168 | 0.72 | — | — | |
| SCHEMBL14647638 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL7715458 | 0.72 | LMNA (0.43) | — | |
| SCHEMBL14040475 | 0.72 | — | — | |
| Pivalamide SCHEMBL2466610 | 0.72 | — | — | |
| SCHEMBL13333875 | 0.72 | — | — | |
| SCHEMBL1287892 | 0.72 | — | — | |
| SCHEMBL13054431 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020102574-A1 | THE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |