⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1668936 | 0.54 | — | — | |
| SCHEMBL11419954 | 0.54 | — | — | |
| SCHEMBL9355997 | 0.51 | APLNR (0.32) | — | |
| SCHEMBL11204686 | 0.51 | — | — | |
| SCHEMBL7670738 | 0.50 | — | — | |
| SCHEMBL23368 | 0.50 | — | — | |
| SCHEMBL1894595 | 0.50 | — | — | |
| SCHEMBL15693706 | 0.50 | — | — | |
| SCHEMBL3813759 | 0.50 | MEN1 (0.30) | — | |
| SCHEMBL11726254 | 0.49 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0051990-A1 | Biologically active heterobicyclic hydroximidates and thiolhydroximidates and carbamate ester derivatives thereof | SDS BIOTECH CORPORATION (US) | 1982-05-19 | — | — | EP | disclosed |