⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3361662 | 0.83 | — | — | |
| SCHEMBL11888149 | 0.82 | MMP2 (0.48) | — | |
| SCHEMBL8854391 | 0.81 | S1PR2 (0.52) | — | |
| SCHEMBL4401995 | 0.79 | S1PR2 (0.55) | — | |
| SCHEMBL9463216 | 0.79 | S1PR2 (0.55) | — | |
| SCHEMBL19349752 | 0.79 | S1PR2 (0.55) | — | |
| SCHEMBL3138275 | 0.79 | S1PR2 (0.55) | — | |
| SCHEMBL9015754 | 0.79 | S1PR2 (0.55) | — | |
| Ethylphosphoramidic Acid SCHEMBL3141508 | 0.79 | MMP2 (0.42) | — | |
| SCHEMBL19348637 | 0.78 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110891923-A | Mixtures comprising Urease Inhibitors (UI) and nitrification inhibitors, such as 2- (3, 4-dimethyl-1H-pyrazol-1-yl) succinic acid (DMPSA) or 3, 4-dimethylpyrazolium glycolate (DMPG) | 巴斯夫欧洲公司 | 2020-03-17 | — | — | CN | claimed |
| CN-110891923-A | Mixtures comprising Urease Inhibitors (UI) and nitrification inhibitors, such as 2- (3, 4-dimethyl-1H-pyrazol-1-yl) succinic acid (DMPSA) or 3, 4-dimethylpyrazolium glycolate (DMPG) | 巴斯夫欧洲公司 | 2020-03-17 | — | — | CN | disclosed |
| US-20130178612-A1 | CHIRAL AUXILIARIES | CHIRALGEN, LTD. (JP) | 2013-07-11 | — | — | US | disclosed |
| EP-1778252-A2 | NONCARDIOTOXIC PHARMACEUTICAL COMPOUNDS | Barbeau, Donald L. (US) | 2007-05-02 | — | — | EP | disclosed |
| US-20070087246-A1 | Materials and methods for making proton exchange polymers, polymer membranes, membrane-electrode assemblies and fuel cells | HYUNDAI MOTOR COMPANY (KR) | 2007-04-19 | — | — | US | disclosed |
| WO-2006020573-A2 | NONCARDIOTOXIC PHARMACEUTICAL COMPOUNDS | BARBEAU DONALD L (US) | 2006-02-23 | — | — | WO | disclosed |
| US-4659722-A | NONPHYTOTOXIC | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1987-04-21 | — | — | US | disclosed |
| EP-0172545-A1 | 3-or 4-pyridinecarboxamide-derivates and their use as bactericides | NIPPON KAYAKU CO., LTD. (JP) | 1986-02-26 | — | — | EP | disclosed |
| US-4410518-A | N-Phosphinoaminosulfinylcarbamate esters and their use as insecticides | REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1983-10-18 | — | — | US | disclosed |
| US-4024277-A | INSECTICIDE AND PESTICIDE | FMC CORPORATION (US) | 1977-05-17 | — | — | US | disclosed |