⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19624327 | 0.80 | TDP1 (0.31) | — | |
| SCHEMBL19624210 | 0.78 | — | — | |
| SCHEMBL19624132 | 0.77 | — | — | |
| SCHEMBL21608962 | 0.74 | TDP1 (0.36) | — | |
| SCHEMBL21770846 | 0.74 | TDP1 (0.36) | — | |
| SCHEMBL21608992 | 0.72 | TDP1 (0.35) | — | |
| SCHEMBL19624105 | 0.71 | — | — | |
| SCHEMBL19624234 | 0.70 | — | — | |
| SCHEMBL29314475 | 0.68 | — | — | |
| SCHEMBL10242843 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3246330-A1 | IMIDAZOLES AS HISTONE DEMETHYLASE INHIBITORS | Istituto Europeo di Oncologia S.r.l. (IT) | 2017-11-22 | — | — | EP | disclosed |