⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29296233 | 0.85 | — | — | |
| SCHEMBL29296219 | 0.77 | — | — | |
| SCHEMBL29296253 | 0.74 | — | — | |
| SCHEMBL12755157 | 0.73 | PIK3CD (0.30) | — | |
| SCHEMBL2706024 | 0.73 | PIK3CD (0.30) | — | |
| SCHEMBL18462581 | 0.72 | TRPA1 (0.30) | — | |
| SCHEMBL29296226 | 0.72 | — | — | |
| SCHEMBL29296221 | 0.71 | — | — | |
| SCHEMBL17189767 | 0.70 | — | — | |
| SCHEMBL17189765 | 0.70 | — | — |
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-20240226113-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | KUMQUAT BIOSCIENCES INC. | 2024-07-11 | — | — | US | disclosed |