SCHEMBL7901205

SCHEMBL7901205

O=S(=O)(Cl)c1c(C2=NOCCO2)cccc1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.32
CES1 P23141 1/20 0.32

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
SCHEMBL7911258 0.72 PKM (0.36)
SCHEMBL9069065 0.72 TRPV4 (0.41) CES1
SCHEMBL27518820 0.71 NOTUM (0.40) NOTUM
SCHEMBL7908092 0.70 TDP2 (0.32) CES1
SCHEMBL8796098 0.69 CA1 (0.35)
SCHEMBL8457965 0.69 CA1 (0.40) NOTUM
SCHEMBL30586543 0.66 SLC22A12 (0.42) CES1
SCHEMBL1501184 0.66 SLC22A12 (0.42) CES1
SCHEMBL30605923 0.66 MCL1 (0.43) CES1
SCHEMBL786275 0.66 MCL1 (0.43) CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6200931-B1 FOR CONTROLLING WEEDS BAYER AKTIENGESELLSCHAFT (DE) 2001-03-13 US disclosed
CN-1234034-A 5,6-dihydro-[1,4,2]-dioxazin-subsd. (hetero) aryl-(oxy-, imino-, alkyl)-sulphonylamino (thio) carbonyl-heterocyclyl derivatives, their prepn. and use as herbicides BAYER AG (DE) 1999-11-03 CN disclosed