⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26825942 | 0.85 | KDM4E (0.35) | — | |
| SCHEMBL22053528 | 0.76 | FAAH (0.40) | — | |
| SCHEMBL22163727 | 0.76 | MEN1 (0.32) | — | |
| SCHEMBL13119958 | 0.75 | NPSR1 (0.40) | — | |
| SCHEMBL17791816 | 0.75 | CYP2C19 (0.31) | — | |
| SCHEMBL23869841 | 0.73 | MEN1 (0.33) | — | |
| SCHEMBL14099840 | 0.72 | — | — | |
| SCHEMBL23436491 | 0.71 | TRPM8 (0.33) | — | |
| SCHEMBL19957298 | 0.70 | MEN1 (0.36) | — | |
| SCHEMBL22643654 | 0.69 | NPSR1 (0.38) | — |
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-20200373500-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE THAT INCLUDES COMPOUND HAVING BENZOAZOLE STRUCTURE | HODOGAYA CHEMICAL CO., LTD. (JP) | 2020-11-26 | — | — | US | disclosed |