⚠ 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 | |
|---|---|---|---|---|
| Carbamic Acid SCHEMBL9516879 | 0.94 | — | — | |
| Carbamic Acid SCHEMBL28049031 | 0.94 | ACHE (0.88) | — | |
| Carbamic Acid SCHEMBL304822 | 0.94 | — | — | |
| Carbamic Acid SCHEMBL27778731 | 0.94 | — | — | |
| Carbamic Acid SCHEMBL11773571 | 0.94 | ACHE (0.88) | — | |
| Carbamic Acid SCHEMBL49149 | 0.94 | — | — | |
| Carbamic Acid SCHEMBL722691 | 0.94 | ACHE (0.88) | — | |
| Carbamic Acid SCHEMBL7077007 | 0.94 | ACHE (0.88) | — | |
| Carbamic Acid SCHEMBL453944 | 0.94 | — | — | |
| Carbamic Acid SCHEMBL7077008 | 0.94 | ACHE (0.88) | — |
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 |