SCHEMBL8465267

SCHEMBL8465267

FC(F)=CCCSc1ncc[nH]1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.46
GRIN2B Q13224 2/20 0.36
HSD11B1 P28845 1/20 0.35
TXN P10599 1/20 0.35
TXNRD1 Q16881 1/20 0.35
GRIN2A Q12879 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
CTSZ Q9UBR2 1/20 0.34
HDAC1 Q13547 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CTSK P43235 1/20 0.31

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
SCHEMBL10577072 0.78 FDPS (0.56) FDPSGRIN2BHSD11B1TXNTXNRD1
SCHEMBL8802798 0.77 FDPS (0.46) FDPSGRIN2BHSD11B1TXNTXNRD1
SCHEMBL1064759 0.77 FDPS (0.50) FDPSGRIN2BHSD11B1TXNTXNRD1
SCHEMBL8752020 0.75 POLB (0.63) LMNAPOLB
SCHEMBL4684558 0.74
SCHEMBL9062692 0.73 CSNK1A1 (0.41)
SCHEMBL7015079 0.73
SCHEMBL719258 0.72 RAB9A (0.41) POLB
SCHEMBL7436419 0.72 FDPS (0.51) FDPSGRIN2BHSD11B1TXNTXNRD1
SCHEMBL8466514 0.71 GPR84 (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
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
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