⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8615572 | 0.88 | CHRNB4 (0.30) | — | |
| SCHEMBL8552474 | 0.78 | — | — | |
| SCHEMBL8551131 | 0.75 | — | — | |
| SCHEMBL8550369 | 0.73 | — | — | |
| SCHEMBL6641986 | 0.73 | — | — | |
| SCHEMBL8551458 | 0.72 | — | — | |
| SCHEMBL8724523 | 0.71 | — | — | |
| SCHEMBL8722587 | 0.70 | — | — | |
| SCHEMBL8722195 | 0.69 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL6754163 | 0.69 | CHRNB4 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0879233-A1 | CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1998-11-25 | — | — | EP | disclosed |
| WO-1997028153-A1 | CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-08-07 | — | — | WO | disclosed |