⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28197266 | 0.77 | — | — | |
| SCHEMBL268525 | 0.71 | — | — | |
| SCHEMBL8979222 | 0.71 | — | — | |
| SCHEMBL237209 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL19136861 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL263253 | 0.69 | — | — | |
| SCHEMBL19199951 | 0.67 | — | — | |
| Water SCHEMBL10317223 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL3118416 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL7340957 | 0.67 | — | — |
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-2016044585-A1 | ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF | Epizyme, Inc. (US) | 2016-03-24 | — | — | WO | disclosed |