⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26880970 | 0.88 | — | — | |
| SCHEMBL26880971 | 0.77 | HTT (0.31) | — | |
| SCHEMBL26880952 | 0.73 | — | — | |
| SCHEMBL26880967 | 0.72 | MEN1 (0.31) | — | |
| SCHEMBL26880954 | 0.72 | — | — | |
| SCHEMBL26880956 | 0.71 | — | — | |
| SCHEMBL26880968 | 0.70 | — | — | |
| SCHEMBL26880965 | 0.70 | MEN1 (0.31) | — | |
| SCHEMBL26880959 | 0.69 | — | — | |
| SCHEMBL19418818 | 0.65 | AURKA (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230365541-A1 | INHIBITOR OF ENHANCER OF ZESTE HOMOLOGUE 2, AND USE THEREOF | XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) | 2023-11-16 | — | — | US | disclosed |