⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17790435 | 0.82 | — | — | |
| SCHEMBL14747670 | 0.72 | MEN1 (0.33) | — | |
| SCHEMBL1392715 | 0.71 | — | — | |
| SCHEMBL9500035 | 0.70 | TRIM24 (0.32) | — | |
| SCHEMBL23056640 | 0.67 | — | — | |
| SCHEMBL27497874 | 0.67 | — | — | |
| SCHEMBL12679295 | 0.65 | — | — | |
| SCHEMBL9360077 | 0.65 | CYP19A1 (0.34) | — | |
| SCHEMBL5573151 | 0.64 | KDM4E (0.32) | — | |
| SCHEMBL10177448 | 0.63 | — | — |
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-1993007119-A1 | NOVEL ANTIMALARIAL PEROXIDES AND PROCESSES FOR THEIR PRODUCTION AND USE | BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) | 1993-04-15 | — | — | WO | disclosed |