⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9625015 | 0.90 | BCL2L1 (0.44) | — | |
| Ethyne SCHEMBL27932680 | 0.79 | CA1 (0.53) | — | |
| SCHEMBL13499 | 0.78 | — | — | |
| Cyanide SCHEMBL27553732 | 0.75 | CA1 (0.50) | — | |
| Ammonia Solution, Strong SCHEMBL27741826 | 0.74 | — | — | |
| Bromide SCHEMBL6770232 | 0.74 | — | — | |
| Fluoride SCHEMBL21816906 | 0.74 | CA1 (0.57) | — | |
| SCHEMBL6560890 | 0.74 | — | — | |
| Ethylene SCHEMBL27518912 | 0.70 | CA1 (0.53) | — | |
| Hydrazine SCHEMBL27364485 | 0.70 | CA1 (0.53) | — |
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 100 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111620792-B | Synthesis method of N, N-disubstituted cyano formamide | 兰州大学 | 2023-01-03 | — | — | CN | claimed |
| CN-114768877-A | Cellulose-loaded Cu2O/TiO2Catalytic material and method for applying catalytic material to boron addition reaction of p-benzoquinone methide | 湖北工程学院 | 2022-07-22 | — | — | CN | claimed |
| CN-112707899-A | Preparation method of quininol | 东莞市东阳光动物保健药品有限公司 | 2021-04-27 | — | — | CN | claimed |
| CN-111205239-A | 1,2, 4-oxadiazole-5-imine derivative and synthetic method thereof | 湖北科技学院 | 2020-05-29 | — | — | CN | claimed |
| EP-2970212-A1 | SUBSTITUTED PYRIDINE AND PYRAZINE COMPOUNDS AS PDE4 INHIBITORS | Dart Neuroscience (Cayman) Ltd (KY) | 2016-01-20 | — | — | EP | claimed |
| CN-104592098-A | Antitumor N-methyl-3,5-diarylmethylene-4-piperidone and quaternary ammonium derivatives thereof | BINZHOU MEDICAL COLLEGE | 2015-05-06 | — | — | CN | claimed |
| WO-2014158998-A1 | SUBSTITUTED PYRIDINE AND PYRAZINE COMPOUNDS AS PDE4 INHIBITORS | DART NEUROSCIENCE, LLC (US) | 2014-10-02 | — | — | WO | claimed |
| EP-1689729-A1 | TETRONIC AND TETRAMIC ACIDS AS INHIBITORS OF BETA-SECREASE | F. Hoffmann-La Roche AG (CH) | 2006-08-16 | — | — | EP | claimed |
| WO-2005058857-A1 | TETRONIC AND TETRAMIC ACIDS AS INHIBITORS OF BETA-SECREASE | F. HOFFMANN-LA ROCHE AG (CH) | 2005-06-30 | — | — | WO | claimed |
| WO-2002068586-A2 | HIV/FIV PROTEASE INHIBITORS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2002-09-06 | — | — | WO | claimed |
| US-6166074-A | Pharmaceutical compositions | NORSK HYDRO A.S. (NO) | 2000-12-26 | — | — | US | claimed |
| EP-0660819-B1 | NEW N,N,N',N'-TETRASUBSTITUTED-1,2-ETHANEDIAMINE DERIVATIVE COMPOUNDS | FERRER INT (ES) | 1997-10-22 | — | — | EP | claimed |
| US-5561135-A | PSYCHOLOGICAL DISORDERS | FERRER INTERNACIONAL, S.A. (ES) | 1996-10-01 | — | — | US | claimed |
| US-5466691-A | Antipsychotic and anxiolytic agents | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1995-11-14 | — | — | US | claimed |
| EP-0660819-A1 | NEW N,N,N',N'-TETRASUBSTITUTED-1,2-ETHANEDIAMINE DERIVATIVE COMPOUNDS. | FERRER INT (ES) | 1995-07-05 | — | — | EP | claimed |
| WO-1995003270-A1 | NEW N,N,N',N'-TETRASUBSTITUTED-1,2-ETHANEDIAMINE DERIVATIVE COMPOUNDS | FERRER INTERNACIONAL, S.A. (ES) | 1995-02-02 | — | — | WO | claimed |
| EP-0034741-B1 | PROCESS FOR THE PREPARATION OF A SUBSTITUTED BROMOFLUOROBENZENE AND 3-BROMO-4-FLUOROBENZONITRILE | RIEDEL-DE HAEN AKTIENGESELLSCHAFT (DE) | 1983-12-21 | — | — | EP | claimed |
| CN-112707899-B | Preparation method of quininol | 东莞市东阳光动物保健药品有限公司 | 2023-10-17 | — | — | CN | disclosed |
| EP-0287890-A1 | Substituted pyrroles | BAYER AG (DE) | 1988-10-26 | — | — | EP | disclosed |
| EP-0282898-A2 | Propiolophenone derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1988-09-21 | — | — | EP | disclosed |