⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7018482 | 0.81 | — | — | |
| SCHEMBL7016817 | 0.81 | GAA (0.32) | — | |
| SCHEMBL22577165 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL3477652 | 0.78 | KDM4E (0.44) | — | |
| SCHEMBL7022034 | 0.76 | HTR7 (0.58) | — | |
| SCHEMBL7023137 | 0.76 | MAPK8 (0.43) | — | |
| SCHEMBL7018146 | 0.75 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL7020542 | 0.74 | APEX1 (0.46) | — | |
| SCHEMBL15165357 | 0.74 | KDM4E (0.35) | — | |
| SCHEMBL18827810 | 0.73 | HTR7 (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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0749433-B1 | (4,4-DIFLUOROBUT-3-ENYLTHIO)-SUBSTITUTED HETEROCYCLIC OR CARBOCYCLIC RING COMPOUNDS HAVING PESTICIDAL ACTIVITY | SYNGENTA LTD (GB) | 2003-05-07 | — | — | EP | claimed |
| EP-0749433-B1 | (4,4-DIFLUOROBUT-3-ENYLTHIO)-SUBSTITUTED HETEROCYCLIC OR CARBOCYCLIC RING COMPOUNDS HAVING PESTICIDAL ACTIVITY | SYNGENTA LTD (GB) | 2003-05-07 | — | — | EP | disclosed |
| US-6156904-A | 2-(4-CHLORO-4,4-DIFLUOROBUTYLTHIO)THIAZOLE USED AS AGRICULTURAL NEMATOCIDE | ZENECA LIMITED (GB) | 2000-12-05 | — | — | US | disclosed |
| US-6025497-A | Processes for the production of 5-chloro-2-(4,4-difluorobut-3-enylsulphonyl)thiazole | ZENECA LIMITED (GB) | 2000-02-15 | — | — | US | disclosed |
| EP-0977744-A1 | PROCESS FOR THE PRODUCTION OF 5-CHLORO-2- (4,4-DIFLUOROBUT-3-ENYLSULPHONYL) THIAZOLE AND INTERMEDIATES THEREFOR | ZENECA LIMITED (GB) | 2000-02-09 | — | — | EP | disclosed |
| US-5952359-A | NEMATICIDES, INSECTICIDES AND MITICIDES; 1,1-DIFLUORO-3-(THIAZOLYL OR ISOTHIAZOYL-THIO (OR SULFINYL OR SULFONYL)-PROP-1-ENE DERIVATIVES | ZENECA LIMITED (GB) | 1999-09-14 | — | — | US | disclosed |
| US-5912243-A | NOVEL COMPOUNDS FOR CONTROLLING NEMATODES, INSECT OR ACARID PESTS | ZENECA LIMITED (GB) | 1999-06-15 | — | — | US | disclosed |
| WO-1998047884-A1 | PROCESS FOR THE PRODUCTION OF 5-CHLORO-2- (4,4-DIFLUOROBUT-3-ENYLSULPHONYL) THIAZOLE AND INTERMEDIATES THEREFOR | ZENECA LIMITED (GB) | 1998-10-29 | — | — | WO | disclosed |
| US-5705516-A | NEMATOCIDES, INSECTICIDES, ACARICIDES | ZENECA LIMITED (GB) | 1998-01-06 | — | — | US | disclosed |
| CN-1143958-A | (4,4-difluorobut-3-enylthio-)-substituted heterocyclic or carbocyclic ring compounds | ZENECA LTD (GB) | 1997-02-26 | — | — | CN | disclosed |
| EP-0749433-A1 | (4,4-DIFLUOROBUT-3-ENYLTHIO)-SUBSTITUTED HETEROCYCLIC OR CARBOCYCLIC RING COMPOUNDS HAVING PESTICIDAL ACTIVITY | ZENECA LIMITED (GB) | 1996-12-27 | — | — | EP | disclosed |
| WO-1995024403-A1 | (4,4-DIFLUOROBUT-3-ENYLTHIO)-SUBSTITUTED HETEROCYCLIC OR CARBOCYCLIC RING COMPOUNDS HAVING PESTICIDAL ACTIVITY | ZENECA LIMITED (GB) | 1995-09-14 | — | — | WO | disclosed |