⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL64911 | 0.64 | — | — | |
| SCHEMBL1992045 | 0.61 | — | — | |
| SCHEMBL9774599 | 0.61 | — | — | |
| SCHEMBL2885121 | 0.60 | — | — | |
| SCHEMBL9774597 | 0.57 | — | — | |
| SCHEMBL9563448 | 0.55 | — | — | |
| SCHEMBL1524914 | 0.55 | — | — | |
| SCHEMBL3846287 | 0.54 | — | — | |
| SCHEMBL2374044 | 0.53 | — | — | |
| SCHEMBL6897683 | 0.51 | — | — |
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-6388061-B1 | INCLUDES RUTHENIUM TRIS(BIPYRIDYL) LABEL BONDED TO THE NITROGEN BASE | DAKO A/S (DK) | 2002-05-14 | — | — | US | claimed |