⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10410742 | 0.90 | CACNA1H (0.46) | — | |
| SCHEMBL10411636 | 0.85 | — | — | |
| SCHEMBL10868108 | 0.77 | — | — | |
| SCHEMBL10869518 | 0.76 | — | — | |
| Bromide SCHEMBL10411929 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL10412603 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL10412609 | 0.75 | — | — | |
| SCHEMBL10867796 | 0.75 | — | — | |
| SCHEMBL6367925 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL10411495 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0178413-A1 | Benzimidazoles | BEECHAM GROUP PLC (GB) | 1986-04-23 | — | — | EP | claimed |
| US-4925853-A | Antiinflammatory, antiallergens, antiulcer agents | BEECHAM GROUP PLC (GB) | 1990-05-15 | — | — | US | disclosed |
| EP-0178413-A1 | Benzimidazoles | BEECHAM GROUP PLC (GB) | 1986-04-23 | — | — | EP | disclosed |