⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1421039 | 0.74 | — | — | |
| SCHEMBL12853893 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL22575344 | 0.72 | — | — | |
| SCHEMBL11237682 | 0.72 | — | — | |
| Diethylamine SCHEMBL10837356 | 0.71 | — | — | |
| SCHEMBL7634606 | 0.71 | — | — | |
| SCHEMBL11253578 | 0.70 | — | — | |
| SCHEMBL20547706 | 0.69 | — | — | |
| SCHEMBL9298742 | 0.67 | — | — | |
| SCHEMBL4026716 | 0.67 | MCL1 (0.32) | — |
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-4311516-A | HERBICIDES; N-DIALKYLPHENYL, N-CHLOROACETYLGLYCINE ESTERS; N-(3,3-DICHLOROALLYL)DICHLOROACETAMINDES | MONTEDISON S.P.A. (IT) | 1982-01-19 | — | — | US | disclosed |
| US-4228101-A | Two dichloroacetamide antidotes for non-selective herbicides particularly active in the protection of maize against the poisonous action exerted by herbicides esters of N,N-disubstituted glycine | MONTEDISON S.P.A. (IT) | 1980-10-14 | — | — | US | disclosed |