⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26288076 | 0.85 | — | — | |
| SCHEMBL24819398 | 0.72 | HRH3 (0.33) | — | |
| SCHEMBL14497312 | 0.72 | HRH3 (0.33) | — | |
| SCHEMBL21942448 | 0.69 | NAMPT (0.46) | — | |
| SCHEMBL22209269 | 0.69 | — | — | |
| SCHEMBL19008943 | 0.67 | HRH3 (0.38) | — | |
| SCHEMBL23435072 | 0.67 | CYP2D6 (0.46) | — | |
| SCHEMBL26999531 | 0.66 | — | — | |
| SCHEMBL25769347 | 0.66 | — | — | |
| SCHEMBL22305872 | 0.64 | KDM4E (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 |
|---|---|---|---|---|---|---|---|
| WO-2023172737-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | KUMQUAT BIOSCIENCES INC. (US) | 2023-09-14 | — | — | WO | disclosed |