SCHEMBL9659646

SCHEMBL9659646

CCCc1cc(Oc2ccccc2)ccc1S(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.52
MMP13 P45452 7/20 0.52
MMP8 P22894 6/20 0.52
MMP12 P39900 6/20 0.52
MMP14 P50281 6/20 0.52
MMP16 P51512 6/20 0.52
MMP9 P14780 5/20 0.52
MMP3 P08254 4/20 0.46
MMP1 P03956 4/20 0.46
HTT P42858 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LTA4H P09960 1/20 0.44
NR1H2 P55055 1/20 0.44
BAX Q07812 1/20 0.44
LMNA P02545 2/20 0.43
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GAA P10253 2/20 0.41
PKM P14618 1/20 0.41
ADAM17 P78536 1/20 0.41

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
SCHEMBL9661649 0.91 MMP2 (0.52) MMP2MMP13MMP8MMP12MMP14
SCHEMBL9660874 0.82 LTA4H (0.47) MMP2MMP13MMP8MMP12MMP14
SCHEMBL9659641 0.79 MMP2 (0.53) MMP2MMP13MMP8MMP12MMP14
SCHEMBL9661773 0.77 LTA4H (0.49) MMP2MMP13MMP8MMP12MMP14
SCHEMBL23430824 0.77 LTA4H (0.69) MMP2MMP13MMP8MMP12MMP14
SCHEMBL416827 0.77 LTA4H (0.69) MMP2MMP13MMP8MMP12MMP14
SCHEMBL9661560 0.75 PKM (0.61) MMP2MMP13MMP8MMP12MMP14
SCHEMBL9662395 0.75 GAA (0.54) MMP2MMP13MMP8MMP12MMP14
SCHEMBL2412893 0.74 LTA4H (0.47) LTA4HNR1H2BAXPPARGPPARD
SCHEMBL5209521 0.74 LTA4H (0.50) HTTLTA4HNR1H2BAXTDP1

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-0466096-A1 Derivatives of 4-hydroxyphenylsulfone JUJO PAPER CO., LTD. (JP) 1992-01-15 EP disclosed