⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18377810 | 0.87 | CYP19A1 (0.33) | — | |
| SCHEMBL10136548 | 0.81 | FFAR4 (0.33) | — | |
| SCHEMBL5888393 | 0.73 | — | — | |
| SCHEMBL21961817 | 0.73 | — | — | |
| SCHEMBL11934375 | 0.73 | CYP19A1 (0.31) | — | |
| SCHEMBL23133729 | 0.73 | — | — | |
| SCHEMBL23114294 | 0.73 | — | — | |
| SCHEMBL21946982 | 0.73 | — | — | |
| SCHEMBL10290749 | 0.73 | — | — | |
| SCHEMBL26287948 | 0.71 | L3MBTL1 (0.33) | — |
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 |