⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3713171 | 1.00 | — | — | |
| SCHEMBL19900855 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL7962851 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL29429357 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL16213498 | 0.96 | — | — | |
| SCHEMBL18067015 | 0.78 | — | — | |
| SCHEMBL19573885 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL20969304 | 0.75 | — | — | |
| SCHEMBL18011037 | 0.73 | — | — | |
| SCHEMBL1269508 | 0.73 | — | — |
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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016183101-A1 | PALLADIUM-CATALYZED ARYLATION OF FLUOROALKYLAMINES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2016-11-17 | — | — | WO | claimed |
| EP-1392693-B1 | TRIAZOLOPYRIMIDINES FUNGICIDES | BAYER CROPSCIENCE AG (DE) | 2007-02-07 | — | — | EP | claimed |
| US-20040176398-A1 | Triazolopyrimidines | BAYER CROPSCIENCE AG (DE) | 2004-09-09 | — | — | US | claimed |
| US-20040157863-A1 | Triazolopyrimidines | BAYER CROPSCIENCE AG (DE) | 2004-08-12 | — | — | US | claimed |
| US-20040142943-A1 | Triazolopyrimidines | BAYER CROPSCIENCE AG (DE) | 2004-07-22 | — | — | US | claimed |
| EP-1397362-A2 | TRIAZOLOPYRIMIDINES HAVING A FUNGICIDAL EFFECT | Bayer CropScience AG (DE) | 2004-03-17 | — | — | EP | claimed |
| EP-1392693-A1 | TRIAZOLOPYRIMIDINES | Bayer CropScience AG (DE) | 2004-03-03 | — | — | EP | claimed |
| EP-1392695-A2 | TRIAZOLOPYRIMIDINES | Bayer CropScience AG (DE) | 2004-03-03 | — | — | EP | claimed |
| WO-2002088126-A1 | TRIAZOLOPYRIMIDINES | BAYER CROPSCIENCE AG (DE) | 2002-11-07 | — | — | WO | claimed |
| WO-2002088127-A2 | TRIAZOLOPYRIMIDINES | BAYER CROPSCIENCE AG (DE) | 2002-11-07 | — | — | WO | claimed |
| WO-2002088125-A2 | TRIAZOLOPYRIMIDINES HAVING A FUNGICIDAL EFFECT | BAYER CROPSCIENCE AG (DE) | 2002-11-07 | — | — | WO | claimed |
| US-6265616-B1 | Manufacture of trifluorisopropylamine | HONEYWELL INTERNATIONAL INC. | 2001-07-24 | — | — | US | claimed |
| CN-118684662-A | Pyrrolopyridone-containing compounds | 正大天晴药业集团股份有限公司 | 2024-09-24 | — | — | CN | disclosed |
| CN-115572269-B | N-trifluoro isopropyl azole and indole compound and preparation method thereof | 广州大学 | 2024-05-17 | — | — | CN | disclosed |
| CN-109251158-B | Thioamidine amide compounds and use thereof for treating hepatitis B | 上海长森药业有限公司 | 2023-05-23 | — | — | CN | disclosed |
| US-11591334-B2 | Substituted pyrrolizines for the treatment of hepatitis B | SHANGHAI LONGWOOD BIOPHARMACEUTICALS CO., LTD. (CN) | 2023-02-28 | — | — | US | disclosed |
| US-6265616-B1 | Manufacture of trifluorisopropylamine | HONEYWELL INTERNATIONAL INC. | 2001-07-24 | — | — | US | disclosed |
| US-6265616-B1 | Manufacture of trifluorisopropylamine | HONEYWELL INTERNATIONAL INC. | 2001-07-24 | — | — | US | disclosed |
| US-6204269-B1 | Fungicidal trifluoromethylalkylamino-triazolopyrimidines | AMERICAN CYANAMID CO. | 2001-03-20 | — | — | US | disclosed |
| US-5986135-A | CHEMICAL INTERMEDIATES | AMERICAN CYANAMID COMPANY (US) | 1999-11-16 | — | — | US | disclosed |