⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3032918 | 0.85 | — | — | |
| SCHEMBL3163383 | 0.76 | — | — | |
| SCHEMBL7054319 | 0.73 | — | — | |
| SCHEMBL1440074 | 0.73 | — | — | |
| SCHEMBL7054833 | 0.71 | — | — | |
| SCHEMBL4376407 | 0.71 | — | — | |
| SCHEMBL7054831 | 0.71 | — | — | |
| SCHEMBL4012108 | 0.67 | — | — | |
| SCHEMBL10955076 | 0.64 | — | — | |
| SCHEMBL10912881 | 0.64 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1429609-A1 | HERBICIDAL MIXTURES BASED ON 3-PHENYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 2004-06-23 | — | — | EP | disclosed |
| EP-1301483-A1 | 1-ARYL-4-ALKYL HALIDE-2(1H)-PYRIDONES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2003-04-16 | — | — | EP | disclosed |
| WO-2003024221-A1 | HERBICIDAL MIXTURES BASED ON 3-PHENYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 2003-03-27 | — | — | WO | disclosed |
| EP-1289970-A1 | 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2003-03-12 | — | — | EP | disclosed |
| WO-2002006233-A1 | 1-ARYL-4-ALKYL HALIDE-2(1H)-PYRIDONES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2002-01-24 | — | — | WO | disclosed |
| WO-2001087863-A1 | 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2001-11-22 | — | — | WO | disclosed |
| US-4166894-A | QUATERNARY AMMONIUM COMPOUNDS OR POLYMERS HAVING AMIDE GROUPS | CALGON CORPORATION (US) | 1979-09-04 | — | — | US | disclosed |
| US-4075136-A | ELECTROCONDUCTIVE COATING | CALGON CORPORATION (US) | 1978-02-21 | — | — | US | disclosed |