⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2380330 | 0.79 | — | — | |
| SCHEMBL11060664 | 0.73 | — | — | |
| SCHEMBL1350240 | 0.72 | — | — | |
| SCHEMBL15766269 | 0.71 | — | — | |
| SCHEMBL23555 | 0.69 | — | — | |
| SCHEMBL7138471 | 0.67 | — | — | |
| SCHEMBL5801974 | 0.67 | — | — | |
| SCHEMBL3016211 | 0.67 | — | — | |
| SCHEMBL155401 | 0.67 | — | — | |
| SCHEMBL9775735 | 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-20090008608-A1 | Sodium/silicon \"treated\" water | DELOACH, JOHN E. | 2009-01-08 | — | — | US | disclosed |