⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8173487 | 0.83 | — | — | |
| SCHEMBL8173483 | 0.83 | — | — | |
| SCHEMBL7955606 | 0.70 | — | — | |
| SCHEMBL7955604 | 0.70 | — | — | |
| SCHEMBL11576167 | 0.67 | — | — | |
| Bromide SCHEMBL17512993 | 0.65 | — | — | |
| SCHEMBL8173095 | 0.62 | — | — | |
| SCHEMBL8173093 | 0.62 | — | — | |
| SCHEMBL190943 | 0.53 | — | — | |
| SCHEMBL8170052 | 0.53 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1366015-A4 | BENZENE-1 2-DIOL MANNICH BASES LIGANDS POLYMERS AND METHOD OF SELECTIVE METAL IONS REMOVAL | TECH RESOURCES PTY LTD (AU) | 2008-03-26 | — | — | EP | disclosed |
| EP-1366015-A1 | BENZENE-1 2-DIOL MANNICH BASES LIGANDS POLYMERS AND METHOD OF SELECTIVE METAL IONS REMOVAL | TECHNOLOGICAL RESOURCES PTY. LTD. (AU) | 2003-12-03 | — | — | EP | disclosed |
| WO-2002070456-A1 | BENZENE-1 2-DIOL MANNICH BASES LIGANDS POLYMERS AND METHOD OF SELECTIVE METAL IONS REMOVAL | TECHNOLOGICAL RESOURCES PTY LIMITED (AU) | 2002-09-12 | — | — | WO | disclosed |