⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29296221 | 0.89 | — | — | |
| SCHEMBL29296256 | 0.78 | PIK3CD (0.37) | — | |
| SCHEMBL29299354 | 0.78 | — | — | |
| SCHEMBL18269023 | 0.77 | CHRNB4 (0.30) | — | |
| SCHEMBL18269025 | 0.77 | CHRNB4 (0.30) | — | |
| SCHEMBL17928305 | 0.76 | AR (0.32) | — | |
| SCHEMBL839891 | 0.76 | AR (0.32) | — | |
| SCHEMBL2705841 | 0.76 | AR (0.32) | — | |
| SCHEMBL29296274 | 0.76 | TRPA1 (0.31) | — | |
| SCHEMBL29299381 | 0.76 | — | — |
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 |