⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1141344 | 0.69 | — | — | |
| Iodide SCHEMBL29025916 | 0.66 | — | — | |
| SCHEMBL14193280 | 0.63 | — | — | |
| SCHEMBL13753798 | 0.57 | — | — | |
| SCHEMBL6267195 | 0.54 | — | — | |
| SCHEMBL18948791 | 0.54 | EEF2K (0.36) | — | |
| SCHEMBL18943024 | 0.51 | — | — | |
| SCHEMBL790574 | 0.51 | — | — | |
| Isopropyl Alcohol SCHEMBL28461707 | 0.49 | ALDH1A1 (0.43) | — | |
| SCHEMBL1706184 | 0.48 | — | — |
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-20120149693-A1 | THERAPEUTIC COMPOUNDS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2012-06-14 | — | — | US | disclosed |