⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1678547 | 0.73 | — | — | |
| SCHEMBL15976378 | 0.71 | — | — | |
| SCHEMBL19575523 | 0.71 | — | — | |
| SCHEMBL8521256 | 0.71 | — | — | |
| SCHEMBL25677238 | 0.71 | — | — | |
| SCHEMBL18653446 | 0.71 | — | — | |
| SCHEMBL8521259 | 0.71 | — | — | |
| SCHEMBL7793682 | 0.69 | — | — | |
| SCHEMBL14639942 | 0.69 | — | — | |
| SCHEMBL12979638 | 0.66 | TRPA1 (0.31) | — |
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-2020033288-A1 | PRMT5 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2020-02-13 | — | — | WO | disclosed |