⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20865551 | 0.74 | — | — | |
| SCHEMBL1286918 | 0.74 | — | — | |
| Iodide SCHEMBL1286886 | 0.72 | — | — | |
| SCHEMBL11868874 | 0.72 | — | — | |
| SCHEMBL15100908 | 0.72 | — | — | |
| SCHEMBL10567071 | 0.71 | — | — | |
| SCHEMBL10970914 | 0.71 | — | — | |
| SCHEMBL25756906 | 0.67 | — | — | |
| SCHEMBL13955492 | 0.66 | — | — | |
| Sulfuric Acid SCHEMBL11687352 | 0.65 | KDM4E (0.58) | — |
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-20160368928-A1 | MELAMPOMAGNOLIDE B DERIVATIVES | BIOVENTURES, LLC | 2016-12-22 | — | — | US | disclosed |