⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5159997 | 0.87 | — | — | |
| SCHEMBL269579 | 0.87 | — | — | |
| SCHEMBL383418 | 0.83 | ACE2 (0.32) | — | |
| SCHEMBL8811486 | 0.79 | LMNA (0.39) | — | |
| SCHEMBL8811527 | 0.79 | LMNA (0.39) | — | |
| SCHEMBL1410786 | 0.75 | — | — | |
| SCHEMBL1410494 | 0.73 | — | — | |
| SCHEMBL17143522 | 0.73 | — | — | |
| SCHEMBL17143810 | 0.73 | — | — | |
| SCHEMBL24736823 | 0.72 | — | — |
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-0468497-B1 | Peptide-antagonists of bombesin/GRP | MERRELL PHARMA INC (US) | 1997-05-28 | — | — | EP | disclosed |
| EP-0468497-A2 | Peptide-antagonists of bombesin/GRP | MERRELL PHARMACEUTICALS INC. (US) | 1992-01-29 | — | — | EP | disclosed |