⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25859261 | 0.89 | — | — | |
| SCHEMBL12299410 | 0.85 | EPHX2 (0.36) | — | |
| SCHEMBL25763548 | 0.85 | EPHX2 (0.36) | — | |
| SCHEMBL25751548 | 0.85 | EPHX2 (0.36) | — | |
| SCHEMBL25965017 | 0.81 | PDK1 (0.31) | — | |
| SCHEMBL15925047 | 0.76 | HRH3 (0.38) | — | |
| SCHEMBL25859158 | 0.76 | HRH3 (0.38) | — | |
| SCHEMBL20147299 | 0.73 | HRH3 (0.42) | — | |
| SCHEMBL24498748 | 0.71 | HRH3 (0.49) | — | |
| SCHEMBL25964915 | 0.71 | PDK1 (0.40) | — |
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-20230227445-A1 | BENZAMIDE COMPOUND AND USE THEREOF | HUMANWELL HEALTHCARE (GROUP) CO., LTD. (CN) | 2023-07-20 | — | — | US | disclosed |