⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13624914 | 0.81 | — | — | |
| SCHEMBL18062291 | 0.81 | — | — | |
| SCHEMBL22519746 | 0.76 | — | — | |
| SCHEMBL14351055 | 0.76 | — | — | |
| SCHEMBL13464398 | 0.65 | — | — | |
| SCHEMBL2114446 | 0.65 | — | — | |
| SCHEMBL19068572 | 0.65 | — | — | |
| SCHEMBL11748933 | 0.61 | — | — | |
| SCHEMBL14214971 | 0.61 | — | — | |
| SCHEMBL2274515 | 0.61 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8137669-B2 | Elimination of heterogeneous or mixed cell population in tumors | IMMUNOGEN, INC. (US) | 2012-03-20 | — | — | US | disclosed |
| EP-2133145-A1 | ELECTRODE CATALYST FOR FUEL CELL | Sumitomo Chemical Company, Limited (JP) | 2009-12-16 | — | — | EP | disclosed |