⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14307905 | 1.00 | — | — | |
| SCHEMBL18896168 | 0.77 | — | — | |
| SCHEMBL12341116 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL4482741 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL4482738 | 0.72 | — | — | |
| SCHEMBL24435578 | 0.70 | — | — | |
| SCHEMBL18896177 | 0.70 | — | — | |
| SCHEMBL23848116 | 0.69 | — | — | |
| SCHEMBL12884514 | 0.69 | — | — | |
| SCHEMBL563325 | 0.67 | — | — |
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-20240217965-A1 | SYNTHESIS OF HETEROCYCLIC COMPOUNDS | PLEXXIKON INC. | 2024-07-04 | — | — | US | disclosed |