⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8009050 | 0.77 | — | — | |
| SCHEMBL8011947 | 0.77 | — | — | |
| SCHEMBL8009333 | 0.77 | — | — | |
| SCHEMBL689709 | 0.69 | — | — | |
| SCHEMBL8000727 | 0.69 | — | — | |
| SCHEMBL8011857 | 0.63 | — | — | |
| SCHEMBL11334417 | 0.61 | — | — | |
| SCHEMBL8009056 | 0.59 | — | — | |
| SCHEMBL8009338 | 0.58 | — | — | |
| SCHEMBL8015954 | 0.56 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060258651-A1 | Use of heterocyclic compounds as scce inhibitors | QUANTUM LTO HOLDINGS, LLC | 2006-11-16 | — | — | US | disclosed |
| US-6083879-A | Herbicidal benzoylisothiazoles | BASF AKTIENGESELLSCHAFT (DE) | 2000-07-04 | — | — | US | disclosed |
| US-6046137-A | FOR CONTROLLING WEEDS | BASF AKTIENGESELLSCHAFT (DE) | 2000-04-04 | — | — | US | disclosed |
| US-5945381-A | Herbicidal heterocyclically annulated benzoylisothiazoles | BASF AKTIENGESELLSCHAFT (DE) | 1999-08-31 | — | — | US | disclosed |