⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24732843 | 0.77 | — | — | |
| SCHEMBL25493001 | 0.74 | — | — | |
| SCHEMBL22782173 | 0.73 | — | — | |
| SCHEMBL9353535 | 0.73 | TRPA1 (0.31) | — | |
| SCHEMBL18854875 | 0.72 | — | — | |
| SCHEMBL11591327 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL10655702 | 0.71 | — | — | |
| Bromide SCHEMBL10656257 | 0.71 | HRH4 (0.31) | — | |
| SCHEMBL3207177 | 0.71 | — | — | |
| SCHEMBL11675396 | 0.70 | — | — |
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-4475942-A | N-Phosphonomethylglycine derivatives and herbicidal compositions containing them | GESHURI LABORATORIES LTD. (IL) | 1984-10-09 | — | — | US | disclosed |
| EP-0103055-A1 | N-phosphonomethylglycine derivatives and herbicidal compositions containing them | Geshuri Laboratories Ltd. (IL) | 1984-03-21 | — | — | EP | disclosed |