⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6741931 | 0.72 | — | — | |
| SCHEMBL28084143 | 0.67 | — | — | |
| SCHEMBL14883238 | 0.65 | — | — | |
| SCHEMBL1533401 | 0.65 | — | — | |
| SCHEMBL5317899 | 0.62 | — | — | |
| SCHEMBL28010648 | 0.62 | — | — | |
| SCHEMBL19629968 | 0.62 | — | — | |
| SCHEMBL8580263 | 0.62 | — | — | |
| SCHEMBL680410 | 0.60 | — | — | |
| SCHEMBL6017119 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2020102599-A1 | TREATING INTRAOCULAR RETINOBLASTOMA WITH INHIBITORS OF HISTONE MODIFICATION | VANDERBILT UNIVERSITY (US) | 2020-05-22 | — | — | WO | disclosed |