⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL301805 | 0.72 | — | — | |
| SCHEMBL537874 | 0.72 | — | — | |
| Methane Boronic Acid SCHEMBL80533 | 0.72 | — | — | |
| SCHEMBL31010617 | 0.72 | — | — | |
| SCHEMBL587269 | 0.72 | — | — | |
| SCHEMBL301796 | 0.72 | — | — | |
| Methane Boronic Acid SCHEMBL20694976 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL6838992 | 0.67 | LMNA (0.38) | — | |
| Methyl Alcohol SCHEMBL4212556 | 0.67 | — | — | |
| SCHEMBL28163404 | 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-20170192018-A1 | METABOLIC BIOMARKERS FOR MEMORY LOSS | THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY | 2017-07-06 | — | — | US | disclosed |