⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL714498 | 0.80 | CTSD (0.46) | — | |
| SCHEMBL11481061 | 0.78 | MDM2 (0.52) | — | |
| SCHEMBL6651381 | 0.77 | PRKCA (0.45) | — | |
| SCHEMBL7723775 | 0.77 | BCHE (0.53) | — | |
| SCHEMBL18920317 | 0.77 | FDPS (0.43) | — | |
| SCHEMBL5167269 | 0.75 | MDM2 (0.48) | — | |
| SCHEMBL13589463 | 0.75 | MDM2 (0.48) | — | |
| SCHEMBL23336901 | 0.74 | — | — | |
| SCHEMBL663956 | 0.74 | — | — | |
| SCHEMBL13254596 | 0.74 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106470973-B | Small molecule L FA-1 inhibitor | 阿罗赛特制药公司 | 2020-08-04 | — | — | 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 |