⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8529518 | 0.93 | — | — | |
| SCHEMBL1713452 | 0.77 | — | — | |
| SCHEMBL14917368 | 0.74 | — | — | |
| SCHEMBL14917342 | 0.72 | — | — | |
| SCHEMBL1397180 | 0.72 | — | — | |
| SCHEMBL960841 | 0.68 | — | — | |
| SCHEMBL14917380 | 0.66 | — | — | |
| SCHEMBL14916868 | 0.66 | — | — | |
| SCHEMBL2471351 | 0.65 | — | — | |
| SCHEMBL1397189 | 0.64 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0636125-B1 | BASIC DERIVATIVES OF GLUTAMIC ACID AND ASPARTIC ACID AS GASTRIN OR CHOLECYSTOKININ ANTAGONISTS | ROTTA RESEARCH LAB (IT) | 1998-03-11 | — | — | EP | claimed |
| US-5587479-A | ANTITUMOR AGENTS, GASTROINTESTINAL DISORDERS | ROTTA RESEARCH LABORATORIUM S.P.A. (IT) | 1996-12-24 | — | — | US | claimed |
| EP-0636125-A1 | BASIC DERIVATIVES OF GLUTAMIC ACID AND ASPARTIC ACID AS GASTRIN OR CHOLECYSTOKININ ANTAGONISTS | ROTTA RESEARCH LABORATORIUM S.P.A. (IT) | 1995-02-01 | — | — | EP | claimed |
| WO-1993021172-A1 | BASIC DERIVATIVES OF GLUTAMIC ACID AND ASPARTIC ACID AS GASTRIN OR CHOLECYSTOKININ ANTAGONISTS | ROTTA RESEARCH LABORATORIUM S.P.A. (IT) | 1993-10-28 | — | — | WO | claimed |