⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24172173 | 1.00 | — | — | |
| SCHEMBL25921599 | 0.93 | HRH3 (0.31) | — | |
| SCHEMBL25933733 | 0.93 | HRH3 (0.31) | — | |
| SCHEMBL20782010 | 0.86 | SPHK1 (0.31) | — | |
| SCHEMBL20781684 | 0.86 | SPHK1 (0.31) | — | |
| SCHEMBL24172165 | 0.84 | — | — | |
| SCHEMBL6944619 | 0.81 | AOC3 (0.30) | — | |
| SCHEMBL22470509 | 0.81 | — | — | |
| SCHEMBL19123304 | 0.80 | CARM1 (0.30) | — | |
| SCHEMBL19011728 | 0.79 | — | — |
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-2023142754-A1 | EZH1/2 INHIBITOR, PREPARATION THEREOF, AND USE THEREOF IN ANTI-TUMOR THERAPY | 江苏天士力帝益药业有限公司 | 2023-08-03 | — | — | WO | disclosed |