SCHEMBL5590959

SCHEMBL5590959

CC(C)(C)Cc1ccccc1S(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.46
RIPK1 Q13546 2/20 0.42
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD11B1 P28845 2/20 0.36
TTR P02766 2/20 0.36
CTSB P07858 1/20 0.36
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
CYP1A2 P05177 1/20 0.34
MMP2 P08253 3/20 0.33
MMP12 P39900 3/20 0.33
MMP13 P45452 3/20 0.33
MMP14 P50281 3/20 0.33
MMP8 P22894 2/20 0.33
MMP16 P51512 2/20 0.33
MMP1 P03956 2/20 0.33
MMP3 P08254 2/20 0.33
MMP9 P14780 2/20 0.33
ALDH1A1 P00352 2/20 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
SCHEMBL31564881 1.00 MYC (0.46) MYCRIPK1TSHRSMN1; SMN2HSD11B1
SCHEMBL11848696 0.86 MYC (0.43) MYCTSHRSMN1; SMN2HSD11B1TTR
SCHEMBL778277 0.82 MYC (0.41) MYCTSHRSMN1; SMN2HSD11B1TTR
SCHEMBL14667166 0.82 RIPK1 (0.43) RIPK1CTSBCYP1A2CYP2D6
SCHEMBL29394818 0.81 CTSB (0.52) MYCTSHRSMN1; SMN2HSD11B1TTR
SCHEMBL34582 0.81 CTSB (0.52) MYCTSHRSMN1; SMN2HSD11B1TTR
Hydrochloric Acid SCHEMBL28128783 0.81 MYC (0.40) MYCTSHRSMN1; SMN2HSD11B1TTR
SCHEMBL779322 0.79 HSD11B1 (0.40) MYCTSHRSMN1; SMN2HSD11B1TTR
Ammonia Solution, Strong SCHEMBL23749173 0.79 CTSB (0.50) MYCTSHRSMN1; SMN2HSD11B1TTR
SCHEMBL2472810 0.79 CTSB (0.50) MYCTSHRSMN1; SMN2HSD11B1TTR

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
JP-2007059610-A ELECTROLYTE FOR DRIVING ELECTROLYTIC CAPACITOR NICHICON CORP 2007-03-08 JP disclosed