⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7211908 | 0.76 | — | — | |
| SCHEMBL15800546 | 0.74 | NPC1 (0.39) | — | |
| SCHEMBL10387999 | 0.73 | TSHR (0.50) | — | |
| SCHEMBL4446043 | 0.72 | GSTP1 (0.53) | — | |
| SCHEMBL24722063 | 0.71 | NPC1 (0.37) | — | |
| SCHEMBL21205900 | 0.71 | NPC1 (0.37) | — | |
| SCHEMBL28916595 | 0.71 | CHRNB2 (0.39) | — | |
| SCHEMBL291486 | 0.71 | NPC1 (0.48) | — | |
| SCHEMBL1401583 | 0.71 | NPC1 (0.48) | — | |
| SCHEMBL23953099 | 0.70 | TSHR (0.41) | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4542609-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO CO. (US) | 1985-09-24 | — | — | US | disclosed |
| US-4471571-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1984-09-18 | — | — | US | disclosed |
| US-4454682-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO CO. (US) | 1984-06-19 | — | — | US | disclosed |
| EP-0011473-B1 | SUBSTITUTED 2-IMINO-1,3-DITHIO AND 1,3-OXATHIO HETEROCYCLIC COMPOUNDS AS HERBICIDAL ANTIDOTES | MONSANTO COMPANY (US) | 1984-04-18 | — | — | EP | disclosed |
| US-4411688-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1983-10-25 | — | — | US | disclosed |
| US-4411689-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1983-10-25 | — | — | US | disclosed |
| US-4410351-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1983-10-18 | — | — | US | disclosed |
| US-4410352-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1983-10-18 | — | — | US | disclosed |
| US-4403444-A | PLANT SAFENING AGENTS | MONSANTO COMPANY (US) | 1983-09-13 | — | — | US | disclosed |
| US-4342586-A | DUE TO THIOCARBAMATE HERBICIDES | MONSANTO COMPANY (US) | 1982-08-03 | — | — | US | disclosed |
| US-4321082-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1982-03-23 | — | — | US | disclosed |
| US-4317310-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1982-03-02 | — | — | US | disclosed |
| US-4307238-A | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1981-12-22 | — | — | US | disclosed |
| US-4231783-A | APPLYING AS A MIXTURE WITH A THIOCARBAMATE OR ACETANILIDE TO RICE, SORGHUM OR WHEAT | MONSANTO COMPANY (US) | 1980-11-04 | — | — | US | disclosed |
| EP-0011473-A1 | Substituted 2-imino-1,3-dithio and 1,3-oxathio heterocyclic compounds as herbicidal antidotes | MONSANTO COMPANY (US) | 1980-05-28 | — | — | EP | disclosed |