⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9418384 | 1.00 | — | — | |
| SCHEMBL6037403 | 1.00 | — | — | |
| SCHEMBL6037427 | 1.00 | — | — | |
| SCHEMBL614053 | 1.00 | — | — | |
| SCHEMBL19409207 | 1.00 | — | — | |
| SCHEMBL37275 | 0.97 | — | — | |
| SCHEMBL10864930 | 0.90 | — | — | |
| SCHEMBL202641 | 0.89 | — | — | |
| SCHEMBL3914929 | 0.84 | — | — | |
| Trimethylammonium SCHEMBL15015633 | 0.82 | — | — |
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-20060222869-A1 | Electropen lithography | ENERGY, UNITED STATES DEPARTMENT | 2006-10-05 | — | — | US | disclosed |