⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8309589 | 1.00 | — | — | |
| SCHEMBL19441 | 0.70 | — | — | |
| SCHEMBL18791 | 0.70 | — | — | |
| SCHEMBL124185 | 0.70 | — | — | |
| SCHEMBL3405183 | 0.70 | — | — | |
| SCHEMBL726045 | 0.67 | — | — | |
| SCHEMBL726046 | 0.67 | — | — | |
| SCHEMBL4466889 | 0.67 | — | — | |
| SCHEMBL7052483 | 0.67 | — | — | |
| SCHEMBL6158902 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114008025-A | ACSS2 inhibitors and methods of use thereof | 美特波米德有限公司 | 2022-02-01 | — | — | CN | disclosed |
| CN-102639509-A | Azole derivative, process for producing the same, intermediate of the same, and agricultural or horticultural agent | KUREHA CORP | 2012-08-15 | — | — | CN | disclosed |
| CN-101778832-A | Oxopyrazine derivative and weedicide | KUMIAI CHEMICAL INDUSTRY CO | 2010-07-14 | — | — | CN | disclosed |
| EP-0955300-A2 | Herbicidal pyridine compounds | American Cyanamid Company (US) | 1999-11-10 | — | — | EP | disclosed |
| US-4567504-A | Semiconductor component with a disc-shaped case | SIEMENS AKTIENGESELLSCHAFT (DE) | 1986-01-28 | — | — | US | disclosed |