⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2751436 | 1.00 | — | — | |
| SCHEMBL10138646 | 0.79 | — | — | |
| SCHEMBL14606030 | 0.79 | — | — | |
| SCHEMBL4570555 | 0.77 | SORT1 (0.40) | — | |
| SCHEMBL18232212 | 0.77 | SORT1 (0.43) | — | |
| SCHEMBL10065608 | 0.76 | CYP1A2 (0.47) | — | |
| SCHEMBL15357779 | 0.76 | FLT3 (0.41) | — | |
| SCHEMBL171800 | 0.76 | HRH4 (0.46) | — | |
| SCHEMBL445950 | 0.74 | — | — | |
| SCHEMBL2745397 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117466863-A | Benzimidazole compound containing aromatic substituent, preparation method and application thereof | 盛睿泽华医药科技（苏州）有限公司 | 2024-01-30 | — | — | CN | disclosed |