⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23823081 | 0.69 | — | — | |
| SCHEMBL26880970 | 0.67 | — | — | |
| SCHEMBL15102902 | 0.64 | CCR8 (0.40) | — | |
| SCHEMBL26880949 | 0.61 | — | — | |
| SCHEMBL27269505 | 0.59 | — | — | |
| SCHEMBL23823301 | 0.57 | HTT (0.33) | — | |
| SCHEMBL11912884 | 0.57 | CCR8 (0.37) | — | |
| SCHEMBL12219421 | 0.56 | CCR8 (0.50) | — | |
| SCHEMBL24810964 | 0.55 | CFB (0.36) | — | |
| SCHEMBL15280126 | 0.55 | CYP1A2 (0.33) | — |
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-2021180235-A1 | INHIBITOR OF ENHANCER OF ZESTE HOMOLOGUE 2, AND USE THEREOF | 四川海思科制药有限公司 | 2021-09-16 | — | — | WO | disclosed |