⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18650145 | 0.81 | CHRNB2 (0.48) | — | |
| SCHEMBL967608 | 0.81 | — | — | |
| SCHEMBL9975571 | 0.79 | — | — | |
| SCHEMBL5244737 | 0.79 | — | — | |
| SCHEMBL19900413 | 0.78 | CHRNB2 (0.61) | — | |
| SCHEMBL15249606 | 0.78 | CHRNB2 (0.46) | — | |
| SCHEMBL5246616 | 0.77 | CHRNB2 (0.46) | — | |
| SCHEMBL20718323 | 0.77 | CHRNB2 (0.46) | — | |
| SCHEMBL28882170 | 0.77 | POLB (0.35) | — | |
| SCHEMBL13788524 | 0.77 | CHRNB2 (0.38) | — |
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-2970132-B1 | ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF | EPIZYME INC (US) | 2020-09-23 | — | — | EP | disclosed |