⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7985183 | 0.82 | CCKBR (0.46) | — | |
| SCHEMBL6333173 | 0.79 | — | — | |
| SCHEMBL6332773 | 0.78 | — | — | |
| SCHEMBL6333179 | 0.78 | — | — | |
| SCHEMBL6160429 | 0.76 | — | — | |
| SCHEMBL6161010 | 0.75 | — | — | |
| SCHEMBL6159839 | 0.74 | — | — | |
| SCHEMBL6161056 | 0.74 | — | — | |
| SCHEMBL6158055 | 0.74 | — | — | |
| SCHEMBL6161939 | 0.73 | — | — |
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-6878734-B2 | Gastrin and cholecystokinin receptor ligands(II) | JAMES BLACK FOUNDATION LIMITED (GB) | 2005-04-12 | — | — | US | disclosed |
| US-20030199565-A1 | Gastrin and cholecystokinin receptor ligands(II) | JAMES BLACK FOUNDATION LIMITED (GB) | 2003-10-23 | — | — | US | disclosed |