⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10363024 | 0.75 | — | — | |
| SCHEMBL15263930 | 0.74 | — | — | |
| SCHEMBL8368565 | 0.67 | TET2 (0.39) | — | |
| SCHEMBL1020281 | 0.67 | — | — | |
| SCHEMBL6784537 | 0.67 | — | — | |
| SCHEMBL8367234 | 0.67 | — | — | |
| SCHEMBL2885289 | 0.63 | — | — | |
| SCHEMBL2066130 | 0.63 | ALDH1A1 (0.30) | — | |
| SCHEMBL3359483 | 0.61 | — | — | |
| SCHEMBL356198 | 0.61 | — | — |
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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0712395-B1 | PROCESS FOR THE PREPARATION OF FLUOROALKENYLTHIO HETEROCYCLIC DERIVATIVES | SYNGENTA LTD (GB) | 2002-05-22 | — | — | EP | claimed |
| US-5914423-A | 4-BROMO-3,4,4-TRIFLUOROBUTYL (ALKYL OR ALKYLPHENYL) SULFONATES; PREPARING 4-BROMO-1,1-DIFLUORO-BUT-1-ENE BY DEBROMOFLUORINATION OF 1,4-DIBROMO-1,1,2-TRIFLUOROBUTANE; CHEMICAL INTERMEDIATES TO NEMATICIDE PRODUCTION | ZENECA, LIMITED (GB) | 1999-06-22 | — | — | US | claimed |
| JP-H09501175-A | — | — | 1997-02-04 | — | — | JP | claimed |
| EP-0712395-A1 | PROCESS FOR THE PREPARATION OF FLUOROATHENYLTHIO HETEROCYCLIC DERIVATIVES | ZENECA LIMITED (GB) | 1996-05-22 | — | — | EP | claimed |
| WO-1995004727-A1 | PROCESS FOR THE PREPARATION OF FLUOROATHENYLTHIO HETEROCYCLIC DERIVATIVES | ZENECA LIMITED (GB) | 1995-02-16 | — | — | WO | claimed |
| US-20060173190-A1 | Nematicidal thiazoline-containing fluorobutenes | BAYER CROPSCIENCE AG (DE) | 2006-08-03 | — | — | US | disclosed |
| EP-1638949-A1 | NEMATICIDAL THIAZOLINE-CONTAINING FLUOROBUTENES | Bayer CropScience AG (DE) | 2006-03-29 | — | — | EP | disclosed |
| WO-2005003107-A1 | NEMATICIDAL THIAZOLINE-CONTAINING FLUOROBUTENES | BAYER CROPSCIENCE AG (DE) | 2005-01-13 | — | — | WO | disclosed |
| 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 |
| EP-0984927-B1 | DERIVATIVES OF 4,4-DIFLUOROBUT-3-ENYLSULFINIC ACID AND THEIR USE AS PESTICIDES | SYNGENTA LTD (GB) | 2003-03-26 | — | — | EP | disclosed |
| EP-0712395-B1 | PROCESS FOR THE PREPARATION OF FLUOROALKENYLTHIO HETEROCYCLIC DERIVATIVES | SYNGENTA LTD (GB) | 2002-05-22 | — | — | EP | disclosed |
| US-6274632-B1 | CONTROLLING AGRICULTURAL INSECTS | ZENECA LIMITED (GB) | 2001-08-14 | — | — | US | disclosed |
| US-5451681-A | Reduction, cyclization | ZENECA LIMITED (GB) | 1995-09-19 | — | — | US | 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 |
| WO-1995019352-A2 | PROCESS FOR THE PREPARATION OF 2-(4,4-DIFLUORO-BUT-3-ENYLTHIO)-BENZ-THIAZOLES AND -BENZOXAZOLES | ZENECA LIMITED (GB) | 1995-07-20 | — | — | WO | disclosed |
| EP-0660830-A1 | BENZOXAZOLE AND BEZOTHIAZOLE DERIVATIVES | ZENECA LIMITED (GB) | 1995-07-05 | — | — | EP | disclosed |
| EP-0660827-A1 | HETEROCYCLIC COMPOUNDS WIHT PARASITICAL ACTIVITY. | ZENECA LTD (GB) | 1995-07-05 | — | — | EP | disclosed |
| WO-1995004727-A1 | PROCESS FOR THE PREPARATION OF FLUOROATHENYLTHIO HETEROCYCLIC DERIVATIVES | ZENECA LIMITED (GB) | 1995-02-16 | — | — | WO | disclosed |
| WO-1994006777-A1 | HETEROCYCLIC COMPOUNDS WIHT PARASITICAL ACTIVITY | ZENECA LIMITED (GB) | 1994-03-31 | — | — | WO | disclosed |
| WO-1994006782-A1 | BENZOXAZOLE AND BEZOTHIAZOLE DERIVATIVES | ZENECA LIMITED (GB) | 1994-03-31 | — | — | WO | disclosed |