⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30893950 | 0.72 | — | — | |
| SCHEMBL1789753 | 0.72 | — | — | |
| SCHEMBL11924859 | 0.72 | — | — | |
| SCHEMBL13380887 | 0.70 | — | — | |
| SCHEMBL26050438 | 0.70 | — | — | |
| SCHEMBL26383216 | 0.70 | — | — | |
| SCHEMBL15803993 | 0.70 | — | — | |
| SCHEMBL9610074 | 0.69 | — | — | |
| SCHEMBL9091781 | 0.69 | — | — | |
| SCHEMBL30707982 | 0.69 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5578622-A | FUNGICIDE OR BACTERICIDE FOR USE IN INDUSTRY, AGRICULTURE AND MEDICINE | ASAMURA PATENT OFFICE (JP) | 1996-11-26 | — | — | US | disclosed |
| EP-0697409-A1 | Isothiazole derivatives containing (an) iodoalkylnyl group(s), their preparation and their use as fungicide and/or bactericide | NIHON NOHYAKU CO., LTD. (JP) | 1996-02-21 | — | — | EP | disclosed |
| US-4153448-A | Novel (alkenyloxy)-, (alkynyloxy) and (cyanoalkoxy) alkoxyphenyl ureas and their use as herbicides | AMERICAN CYANAMID COMPANY (US) | 1979-05-08 | — | — | US | disclosed |
| US-4046797-A | HERBICIDES | AMERICAN CYANAMID COMPANY (US) | 1977-09-06 | — | — | US | disclosed |
| US-4046808-A | (Alkenyloxy)-, (alkynyloxy) and (cyanoalkoxy) alkoxyphenyl ureas and their use as herbicides | AMERICAN CYANAMID COMPANY (US) | 1977-09-06 | — | — | US | disclosed |
| US-3954441-A | (Alkynyloxy)alkyl and (alkenyloxy)alkyl carbamates and their use as herbicides | AMERICAN CYANAMID COMPANY (US) | 1976-05-04 | — | — | US | disclosed |
| US-3929905-A | Chloromethyl 1,1-dimethyl-2-propynyl ether and process | AMERICAN CYANAMID CO | 1975-12-30 | — | — | US | disclosed |
| US-3929905-A | Chloromethyl 1,1-dimethyl-2-propynyl ether and process | AMERICAN CYANAMID CO | 1975-12-30 | — | — | US | disclosed |