⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3776593 | 0.72 | CA1 (0.33) | — | |
| SCHEMBL3257454 | 0.71 | — | — | |
| SCHEMBL29469898 | 0.70 | CA1 (0.38) | — | |
| SCHEMBL7901217 | 0.70 | CA1 (0.38) | — | |
| SCHEMBL3782693 | 0.67 | CA12 (0.43) | — | |
| SCHEMBL8632281 | 0.66 | GAA (0.33) | — | |
| SCHEMBL7911258 | 0.66 | PKM (0.36) | — | |
| SCHEMBL8796098 | 0.66 | CA1 (0.35) | — | |
| SCHEMBL4614937 | 0.66 | — | — | |
| SCHEMBL3948671 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7557067-B2 | Pyrazole sulfonylurea compound and herbicide | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2009-07-07 | — | — | US | disclosed |
| US-20080064600-A1 | Pyrazole Sulfonylurea Compound and Herbicide | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2008-03-13 | — | — | US | disclosed |