⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27503629 | 0.77 | SLC6A2 (0.48) | — | |
| SCHEMBL7680971 | 0.77 | CYP3A4 (0.67) | — | |
| SCHEMBL20710609 | 0.77 | CYP3A4 (0.48) | — | |
| SCHEMBL2081194 | 0.77 | — | — | |
| SCHEMBL2639851 | 0.77 | — | — | |
| SCHEMBL16781699 | 0.77 | DPP4 (0.50) | — | |
| SCHEMBL1892118 | 0.77 | CYP3A4 (0.48) | — | |
| SCHEMBL3851200 | 0.74 | TAAR1 (0.60) | — | |
| SCHEMBL387892 | 0.72 | — | — | |
| SCHEMBL1515379 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113248425-B | Two-dimensional Ag (I) complex synthesized based on silver hexafluorophosphate as well as synthesis method and application thereof | 天津师范大学 | 2022-11-08 | — | — | CN | claimed |
| CN-113248526-B | Two-dimensional Ag (I) complex synthesized based on silver trifluoroacetate and synthesis method and application thereof | 天津师范大学 | 2022-05-31 | — | — | CN | claimed |
| CN-113248527-B | Three-dimensional Ag (I) complex synthesized based on silver methylsulfonate and synthesis method and application thereof | 天津师范大学 | 2022-05-31 | — | — | CN | claimed |
| CN-113248528-B | Three-dimensional Ag (I) complex synthesized based on silver hexafluorosilicate and synthesis method and application thereof | 天津师范大学 | 2022-05-31 | — | — | CN | claimed |
| CN-113248526-B | Two-dimensional Ag (I) complex synthesized based on silver trifluoroacetate and synthesis method and application thereof | 天津师范大学 | 2022-05-31 | — | — | CN | disclosed |
| CN-113248528-B | Three-dimensional Ag (I) complex synthesized based on silver hexafluorosilicate and synthesis method and application thereof | 天津师范大学 | 2022-05-31 | — | — | CN | disclosed |
| CN-113248527-B | Three-dimensional Ag (I) complex synthesized based on silver methylsulfonate and synthesis method and application thereof | 天津师范大学 | 2022-05-31 | — | — | CN | disclosed |
| CN-104854091-B | The amine derivative of 5 fluorine N (base of pyridine 2) pyridine 2 containing sulfone group | 拜耳药业股份公司 | 2018-04-03 | — | — | CN | disclosed |
| CN-105102444-B | Sulfomimino-containing 5-fluoro-N- (pyridin-2-yl) pyridin-2-amine derivatives | 拜耳医药股份有限公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-105283453-A | N- (pyridin-2-yl) pyrimidin-4-amine derivatives containing sulfone group | Bayer Pharma AG | 2016-01-27 | — | — | CN | disclosed |
| CN-105102444-A | Sulfomimino-containing 5-fluoro-N- (pyridin-2-yl) pyridin-2-amine derivatives | Bayer Pharma AG | 2015-11-25 | — | — | CN | disclosed |
| CN-104918932-A | N-(pyridin-2-yl)pyrimidin-4-amine derivatives containing a sulfoximine group | Bayer Pharma AG | 2015-09-16 | — | — | CN | disclosed |
| CN-104854091-A | 5-fluoro-n-(pyridin-2-yl)pyridin-2-amine derivatives containing a sulfone group | Bayer Pharma AG | 2015-08-19 | — | — | CN | disclosed |
| EP-2578579-A1 | Benzothiophene carboxamide compounds, composition and applications thereof | National Institute of Immunology (IN) | 2013-04-10 | — | — | EP | disclosed |
| US-20120016014-A1 | BENZOTHIOPHENE CARBOXAMIDE COMPOUNDS, COMPOSITION AND APPLICATIONS THEREOF | INDIAN INSTITUTE OF SCIENCE (IN) | 2012-01-19 | — | — | US | disclosed |
| US-3953463-A | 2-Aryl-6-trifluoromethyl-4-pyridyl-carbinolamine antimalarials | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1976-04-27 | — | — | US | disclosed |
| US-3940404-A | PLASMODIAL INFECTIONS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1976-02-24 | — | — | US | disclosed |
| US-3886167-A | 2-Aryl-6-trifluoromethyl-4-pyridylcarbinolamine antimalarials | US ARMY | 1975-05-27 | — | — | US | disclosed |
| US-3764604-A | 4-PYRIDYLCARBINOLAMINE ANTI-MALARIALS | US ARMY | 1973-10-09 | — | — | US | disclosed |