⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25910761 | 0.75 | HRH3 (0.40) | — | |
| SCHEMBL29299659 | 0.68 | — | — | |
| SCHEMBL14591903 | 0.68 | — | — | |
| SCHEMBL29299284 | 0.68 | CYP2D6 (0.32) | — | |
| SCHEMBL29299289 | 0.66 | — | — | |
| SCHEMBL29299287 | 0.65 | HSD11B1 (0.30) | — | |
| SCHEMBL2706858 | 0.65 | PIK3CD (0.34) | — | |
| SCHEMBL15429767 | 0.63 | — | — | |
| SCHEMBL10118832 | 0.63 | MEN1 (0.34) | — | |
| SCHEMBL2707434 | 0.63 | MEN1 (0.34) | — |
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 |