⚠ 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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL27724988 | 0.81 | ALDH1A1 (0.46) | — | |
| SCHEMBL1076387 | 0.77 | — | — | |
| SCHEMBL5800854 | 0.76 | — | — | |
| SCHEMBL1452385 | 0.76 | — | — | |
| SCHEMBL6673952 | 0.75 | — | — | |
| SCHEMBL11285037 | 0.75 | — | — | |
| SCHEMBL15543602 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL16649758 | 0.75 | — | — | |
| SCHEMBL3806548 | 0.75 | — | — | |
| SCHEMBL7487070 | 0.75 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7326705-B2 | Heterocyclic sodium/proton exchange inhibitors and method | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-02-05 | — | — | US | claimed |
| EP-1224183-B1 | HETEROCYCLIC SODIUM/PROTON EXCHANGE INHIBITORS AND METHOD | BRISTOL MYERS SQUIBB CO (US) | 2005-12-28 | — | — | EP | claimed |
| US-20050137216-A1 | Heterocyclic sodium/proton exchange inhibitors and method | AHMAD SALEEM (US) | 2005-06-23 | — | — | US | claimed |
| US-6887870-B1 | Heterocyclic sodium/proton exchange inhibitors and method | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-05-03 | — | — | US | claimed |
| EP-1105412-A1 | SERINE PROTEASE INHIBITORS COMPRISING ALPHA-KETO HETEROCYCLES | CORTECH, INC. (US) | 2001-06-13 | — | — | EP | claimed |
| US-6159938-A | Serine protease inhibitors comprising α-keto heterocycles | CORTECH, INC. | 2000-12-12 | — | — | US | claimed |
| WO-2000009542-A1 | SERINE PROTEASE INHIBITORS COMPRISING α-KETO HETEROCYCLES | CORTECH, INC. (US) | 2000-02-24 | — | — | WO | claimed |
| EP-0693072-A4 | METHOD FOR THE SYNTHESIS OF 4- AND/OR 5-(DI)SUBSTITUTED 2-AMINOIMIDAZOLES FROM 2-AMINOIMIDAZOLES AND ALDEHYDES | UNIV COLUMBIA (US) | 1997-09-24 | — | — | EP | claimed |
| EP-0693072-A1 | METHOD FOR THE SYNTHESIS OF 4- AND/OR 5-(DI)SUBSTITUTED 2-AMINOIMIDAZOLES FROM 2-AMINOIMIDAZOLES AND ALDEHYDES | The Trustees of Columbia University in the City of New York (US) | 1996-01-24 | — | — | EP | claimed |
| WO-1994024136-A1 | METHOD FOR THE SYNTHESIS OF 4- AND/OR 5-(DI)SUBSTITUTED 2-AMINOIMIDAZOLES FROM 2-AMINOIMIDAZOLES AND ALDEHYDES | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 1994-10-27 | — | — | WO | claimed |
| US-7326705-B2 | Heterocyclic sodium/proton exchange inhibitors and method | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-02-05 | — | — | US | disclosed |
| US-20050137216-A1 | Heterocyclic sodium/proton exchange inhibitors and method | AHMAD SALEEM (US) | 2005-06-23 | — | — | US | disclosed |
| US-6887870-B1 | Heterocyclic sodium/proton exchange inhibitors and method | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-05-03 | — | — | US | disclosed |
| US-6218549-B1 | KETAL AMINOIMIDAZOLE COMPOUND AND A N-(2-FORMYLETHYL)PYRROLE-2-CARBOXAMIDE; PREPARATION; METABOLITES | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK | 2001-04-17 | — | — | US | disclosed |
| US-6103899-A | Bicyclic aminoimidazoles | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2000-08-15 | — | — | US | disclosed |
| US-5834609-A | Bicyclic aminoimidazoles | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 1998-11-10 | — | — | US | disclosed |
| EP-0693072-A4 | METHOD FOR THE SYNTHESIS OF 4- AND/OR 5-(DI)SUBSTITUTED 2-AMINOIMIDAZOLES FROM 2-AMINOIMIDAZOLES AND ALDEHYDES | UNIV COLUMBIA (US) | 1997-09-24 | — | — | EP | disclosed |
| EP-0693072-A1 | METHOD FOR THE SYNTHESIS OF 4- AND/OR 5-(DI)SUBSTITUTED 2-AMINOIMIDAZOLES FROM 2-AMINOIMIDAZOLES AND ALDEHYDES | The Trustees of Columbia University in the City of New York (US) | 1996-01-24 | — | — | EP | disclosed |
| WO-1994024136-A1 | METHOD FOR THE SYNTHESIS OF 4- AND/OR 5-(DI)SUBSTITUTED 2-AMINOIMIDAZOLES FROM 2-AMINOIMIDAZOLES AND ALDEHYDES | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 1994-10-27 | — | — | WO | disclosed |