SCHEMBL11501339

SCHEMBL11501339

O=S(=O)(c1ccc(O)cc1)c1ccccc1-c1cccc(S(=O)(=O)S(=O)(=O)c2ccccc2)c1-c1ccccc1S(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
GFER P55789 1/20 0.44
ESR1 P03372 2/20 0.38
HTR6 P50406 5/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ERAP1 Q9NZ08 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
MMP1 P03956 2/20 0.35
MMP2 P08253 2/20 0.35
MMP9 P14780 2/20 0.35
MMP8 P22894 2/20 0.35
MMP12 P39900 2/20 0.35
MMP13 P45452 2/20 0.35
MMP14 P50281 2/20 0.35
MMP16 P51512 2/20 0.35
STAT3 P40763 1/20 0.35

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
SCHEMBL10864166 0.83 POLB (0.43) POLBGAAGFERESR1HTR6
SCHEMBL7113719 0.78 ABL1 (0.39) POLBGAAGFERESR1MMP9
SCHEMBL6899092 0.76 POLB (0.54) POLBGAAGFERHTR6KMT2A
SCHEMBL9793431 0.74 HTR6 (0.62) POLBGAAGFERHTR6KMT2A
SCHEMBL1028866 0.74 POLB (0.49) POLBGAAGFERHTR6KMT2A
SCHEMBL11264693 0.73 GAA (0.57) POLBGAAGFERESR1HTR6
SCHEMBL13241419 0.72 ALDH1A1 (0.56) POLBGAAKMT2ATDP1STAT3
SCHEMBL10864169 0.72 POLB (0.55) POLBGAAGFERESR1HTR6
SCHEMBL6687729 0.72 POLB (0.46) POLBGAAGFERKMT2AHTT
Phenol SCHEMBL6905378 0.71 HTR6 (0.62) POLBGAAGFERESR1HTR6

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
EP-0010595-A1 Bis(4-hydroxyphenylthiophenyl)biphenyldisulphones and bis(4-hydroxyphenyl-sulphonylphenyl)-biphenyldisulphones, their preparation and their use Mobay Chemical Corporation (US) 1980-05-14 EP disclosed