⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5475632 | 0.71 | — | — | |
| SCHEMBL104881 | 0.70 | L3MBTL1 (0.37) | — | |
| SCHEMBL11922811 | 0.67 | L3MBTL1 (0.35) | — | |
| SCHEMBL11407139 | 0.66 | L3MBTL1 (0.55) | — | |
| SCHEMBL16352362 | 0.62 | — | — | |
| SCHEMBL11476258 | 0.59 | — | — | |
| SCHEMBL4528494 | 0.58 | — | — | |
| SCHEMBL9257241 | 0.58 | — | — | |
| SCHEMBL9257238 | 0.58 | — | — | |
| SCHEMBL1488407 | 0.58 | — | — |
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-20120059162-A1 | FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION | ONCOTHERAPY SCIENCE, INC. (JP) | 2012-03-08 | — | — | US | disclosed |