⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5694210 | 0.78 | — | — | |
| SCHEMBL15799735 | 0.75 | — | — | |
| SCHEMBL7362129 | 0.67 | — | — | |
| SCHEMBL518032 | 0.65 | — | — | |
| SCHEMBL6477842 | 0.65 | — | — | |
| SCHEMBL977204 | 0.64 | — | — | |
| Methane SCHEMBL28323479 | 0.62 | — | — | |
| SCHEMBL3985228 | 0.61 | — | — | |
| SCHEMBL3342 | 0.60 | — | — | |
| SCHEMBL11801667 | 0.60 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6908884-B2 | Benzazolonylcarbonylcyclohexenones and their use as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2005-06-21 | — | — | US | disclosed |
| US-20040063584-A1 | Benzazolonylcarbonylcyclohexenones and their use ss herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2004-04-01 | — | — | US | disclosed |
| US-20040033899-A1 | 5[(pyrazol-4-yl)carbonyl]benzazolone as herbicide | BASF AKTIENGESELLSCHAFT (DE) | 2004-02-19 | — | — | US | disclosed |
| US-6589915-B1 | The invention relates to cyclohexenone derivatives of benzo-condensed, unsaturated 5-ring nitrogen heterocycles of general formula (I) wherein X represents N or a group C-R3, Y represents O, S, SO, SO2 or NR4 or X-Y represent S | BASF AKTIENGESELLSCHAFT (DE) | 2003-07-08 | — | — | US | disclosed |
| US-6541423-B1 | Controlling vegatation | BASF AKTIENGESELLSCHAFT (DE) | 2003-04-01 | — | — | US | disclosed |
| US-6352959-B1 | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2002-03-05 | — | — | US | disclosed |