⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL160445 | 0.67 | — | — | |
| SCHEMBL152938 | 0.67 | — | — | |
| SCHEMBL11034571 | 0.67 | — | — | |
| SCHEMBL11960736 | 0.67 | — | — | |
| Thioacetamide SCHEMBL805065 | 0.64 | — | — | |
| SCHEMBL13694516 | 0.64 | — | — | |
| SCHEMBL5839330 | 0.64 | — | — | |
| SCHEMBL12329890 | 0.64 | — | — | |
| SCHEMBL13425285 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL2937376 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0116452-B1 | IMPROVEMENTS IN OR RELATING TO THE SYNTHESIS OF NIZATIDINE | ELI LILLY AND COMPANY (US) | 1993-01-13 | — | — | EP | claimed |
| US-4587344-A | Isothiourea synthesis process | ELI LILLY AND COMPANY (US) | 1986-05-06 | — | — | US | claimed |
| EP-0116452-A2 | Improvements in or relating to the synthesis of nizatidine | ELI LILLY AND COMPANY (US) | 1984-08-22 | — | — | EP | claimed |
| WO-2012028582-A1 | HERBICIDALLY ACTIVE KETOSULTAMS AND DIKETOPYRIDINES | BAYER CROPSCIENCE AG (DE) | 2012-03-08 | — | — | WO | disclosed |
| EP-1546152-B1 | EPOTHILONE DERIVATIVES | NOVARTIS AG (CH) | 2007-12-19 | — | — | EP | disclosed |
| US-7256211-B1 | 8-azaprostaglandin derivatives and medical use thereof | ONO PHARMACEUTICAL CO., LTD. (JP) | 2007-08-14 | — | — | US | disclosed |
| US-20040082781-A1 | Bicyclic nitrogenous fused-ring compound | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2004-04-29 | — | — | US | disclosed |
| EP-0116452-B1 | IMPROVEMENTS IN OR RELATING TO THE SYNTHESIS OF NIZATIDINE | ELI LILLY AND COMPANY (US) | 1993-01-13 | — | — | EP | disclosed |
| US-4587344-A | Isothiourea synthesis process | ELI LILLY AND COMPANY (US) | 1986-05-06 | — | — | US | disclosed |
| US-4587344-A | Isothiourea synthesis process | ELI LILLY AND COMPANY (US) | 1986-05-06 | — | — | US | disclosed |
| EP-0116452-A2 | Improvements in or relating to the synthesis of nizatidine | ELI LILLY AND COMPANY (US) | 1984-08-22 | — | — | EP | disclosed |