⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25009921 | 0.78 | — | — | |
| SCHEMBL21478000 | 0.72 | FDPS (0.33) | — | |
| SCHEMBL14318587 | 0.65 | — | — | |
| SCHEMBL7540221 | 0.64 | — | — | |
| SCHEMBL19054898 | 0.64 | — | — | |
| SCHEMBL3642469 | 0.64 | — | — | |
| SCHEMBL3642472 | 0.64 | — | — | |
| SCHEMBL21311527 | 0.62 | — | — | |
| SCHEMBL25021121 | 0.62 | — | — | |
| SCHEMBL16408973 | 0.62 | — | — |
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-2015200709-A1 | HISTONE DEMETHYLASE INHIBITORS | Quanticel Pharmaceuticals, Inc. (US) | 2015-12-30 | — | — | WO | disclosed |