⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6499879 | 0.74 | CNR2 (0.37) | — | |
| SCHEMBL6499872 | 0.74 | CNR2 (0.37) | — | |
| SCHEMBL6244320 | 0.66 | SLC6A2 (0.39) | — | |
| SCHEMBL6249082 | 0.66 | POLB (0.43) | — | |
| SCHEMBL6500100 | 0.65 | AAK1 (0.34) | — | |
| SCHEMBL6276894 | 0.64 | KDM4E (0.34) | — | |
| SCHEMBL2880619 | 0.64 | ALDH1A1 (0.44) | — | |
| SCHEMBL6499678 | 0.64 | OPRL1 (0.37) | — | |
| SCHEMBL6264030 | 0.62 | SLC6A2 (0.35) | — | |
| SCHEMBL6244735 | 0.62 | SLC6A2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6919331-B2 | Substituted 2-methyl-benzimidazole respiratory syncytial virus antiviral agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-07-19 | — | — | US | disclosed |
| US-20030207868-A1 | Substituted 2-methyl-benzimidazole respiratory syncytial virus antiviral agents | BRISTOL-MYERS SQUIBB COMPANY | 2003-11-06 | — | — | US | disclosed |