SCHEMBL7269139

SCHEMBL7269139

CS(=O)(=O)c1ccccc1S.[Zn]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.39
PTGS2 P35354 2/20 0.36
LOX P28300 1/20 0.36
DRD2 P14416 1/20 0.35
HSD11B1 P28845 1/20 0.35
JAK2 O60674 1/20 0.35
JAK3 P52333 1/20 0.35
PTK2 Q05397 1/20 0.35
GAA P10253 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
ADRA1A P35348 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL944099 0.98 BCAT2 (0.40) BCAT2PTGS2LOXDRD2HSD11B1
SCHEMBL29644921 0.98 BCAT2 (0.40) BCAT2PTGS2LOXDRD2HSD11B1
SCHEMBL7262689 0.82 BCAT2 (0.33) BCAT2LOXJAK2JAK3PTK2
SCHEMBL8106699 0.79 LOX (0.47) BCAT2PTGS2LOXDRD2HSD11B1
SCHEMBL30948577 0.77 GAA (0.50) GAACA1CA2CA4CA6
SCHEMBL3279998 0.77 GAA (0.50) GAACA1CA2CA4CA6
SCHEMBL27875230 0.76 ALDH1A1 (0.42) GAACA1CA2CA4CA6
SCHEMBL27914335 0.76 HTR6 (0.36) GAACA1CA2CA4CA6
SCHEMBL27996869 0.74 PSIP1 (0.48) HSD11B1GAAALOX5APFEN1ADRA2A
SCHEMBL4613245 0.73 ALDH1A1 (0.44) GAACA1CA2CA4CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6583229-B2 Core layer is formed by vulcanizing and press molding a rubber composition of a base rubber, crosslinking agent, organic peroxide, filler, and a benzene mercaptan, polysufide, or metal sulfide; exceptional rebound, flight, shot feel SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2003-06-24 US claimed