⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4388739 | 0.95 | — | — | |
| SCHEMBL9053323 | 0.95 | — | — | |
| SCHEMBL15812698 | 0.95 | — | — | |
| SCHEMBL18824151 | 0.95 | — | — | |
| SCHEMBL9062624 | 0.95 | — | — | |
| SCHEMBL2947629 | 0.95 | — | — | |
| SCHEMBL11706276 | 0.95 | — | — | |
| SCHEMBL149252 | 0.95 | — | — | |
| SCHEMBL2679499 | 0.95 | — | — | |
| Water SCHEMBL4441685 | 0.93 | — | — |
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-2016108489-A1 | NOVEL RUTHENIUM COMPOUND, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER, CONTAINING SAME AS ACTIVE INGREDIENT | 울산대학교 산학협력단 | 2016-07-07 | — | — | WO | disclosed |