SCHEMBL7024852

SCHEMBL7024852

O=C(O)c1csc(SCCC=C(F)F)n1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 13/20 0.41
PTGER2 P43116 13/20 0.41
PTGER4 P35408 10/20 0.41
PTGER1 P34995 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL7022732 0.88 HTR2B (0.36) PTGER3PTGER2PTGER4PTGER1
SCHEMBL7019281 0.81 RAB9A (0.49)
SCHEMBL7025782 0.77 HTR1A (0.41)
SCHEMBL9750229 0.76 APEX1 (0.53) PTGER3PTGER2PTGER4
SCHEMBL12964413 0.76 PLA2G4A (0.48) PTGER3PTGER2PTGER4PTGER1
SCHEMBL7023733 0.75 RAB9A (0.31)
SCHEMBL9749568 0.73 L3MBTL1 (0.43)
SCHEMBL12964364 0.73 PLA2G4A (0.46) PTGER3PTGER2PTGER4
SCHEMBL8752079 0.71 ALOX15 (0.38)
SCHEMBL7025903 0.71 APEX1 (0.31)

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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