⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL11661282 | 0.82 | OPRM1 (0.32) | — | |
| Ammonia Solution, Strong SCHEMBL10949411 | 0.80 | CYP1A2 (0.31) | — | |
| SCHEMBL27936332 | 0.79 | HTR2A (0.30) | — | |
| Ammonia Solution, Strong SCHEMBL11655258 | 0.79 | DNM1 (0.38) | — | |
| SCHEMBL2360921 | 0.75 | — | — | |
| SCHEMBL2715629 | 0.74 | OPRM1 (0.31) | — | |
| SCHEMBL9697340 | 0.73 | CPB2 (0.36) | — | |
| SCHEMBL4999595 | 0.73 | — | — | |
| SCHEMBL9699644 | 0.72 | CPB2 (0.35) | — | |
| SCHEMBL9698378 | 0.72 | CPB2 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013043133-A1 | METHODS FOR FORMING GOLD NANOWIRES ON A SUBSTRATE AND GOLD NANOWIRES FORMED THEREOF | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2013-03-28 | — | — | WO | disclosed |