⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16496649 | 0.82 | TSHR (0.41) | — | |
| SCHEMBL16497347 | 0.75 | — | — | |
| SCHEMBL6626466 | 0.75 | — | — | |
| SCHEMBL467840 | 0.73 | — | — | |
| SCHEMBL16496841 | 0.71 | DNM1 (0.36) | — | |
| SCHEMBL2099704 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28032105 | 0.70 | — | — | |
| SCHEMBL7908504 | 0.70 | — | — | |
| SCHEMBL23701228 | 0.69 | — | — | |
| SCHEMBL12940304 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1261613-B1 | GASTRO-SPECIFIC PRODRUGS | PHARMACIA CORP (US) | 2004-05-06 | — | — | EP | disclosed |
| EP-1261613-A1 | GASTRO-SPECIFIC PRODRUGS | Pharmacia Corporation (US) | 2002-12-04 | — | — | EP | disclosed |
| US-6413945-B1 | REACTION PRODUCT OF ORGANOSILICON COMPOUNDS AND DRUG; ANTIULCER AGENTS | PHARMACIA CORPORATION | 2002-07-02 | — | — | US | disclosed |
| WO-2001064690-A1 | GASTRO-SPECIFIC PRODRUGS | PHARMACIA CORPORATION (US) | 2001-09-07 | — | — | WO | disclosed |
| US-6030959-A | FOR TREATMENT AND PROPHYLAXIS OF GASTRIC ULCERS | MONSANTO COMPANY (US) | 2000-02-29 | — | — | US | disclosed |