SCHEMBL9636032

SCHEMBL9636032

COc1ccc(S(=O)(=O)O)cc1N.Nc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
MMP1 P03956 1/20 0.60
MMP2 P08253 1/20 0.60
MMP9 P14780 1/20 0.60
MMP8 P22894 1/20 0.60
MMP13 P45452 1/20 0.60
ALDH1A1 P00352 8/20 0.58
TSHR P16473 3/20 0.58
NT5E P21589 1/20 0.58
F2 P00734 3/20 0.57
PRSS1 P07477 3/20 0.57
PRSS2 P07478 3/20 0.57
PRSS3 P35030 3/20 0.57
HSD17B10 Q99714 3/20 0.50
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TDP1 Q9NUW8 2/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL155353 0.93 CA1 (0.68) CA1CA2MMP1MMP2MMP9
Potassium SCHEMBL14988998 0.92 CA1 (0.66) CA1CA2MMP1MMP2MMP9
SCHEMBL9817020 0.92 CA1 (0.66) CA1CA2MMP1MMP2MMP9
SCHEMBL14988995 0.92 CA1 (0.66) CA1CA2MMP1MMP2MMP9
Nitrogen SCHEMBL29022401 0.90 CA1 (0.64) CA1CA2MMP1MMP2MMP9
SCHEMBL9684568 0.86 CA1 (0.59) CA1CA2MMP1MMP2MMP9
SCHEMBL11158604 0.84 TSHR (0.58) CA1CA2MMP1MMP2MMP9
Sulfuric Acid SCHEMBL29558209 0.81 CA1 (0.56) CA1CA2MMP1MMP2MMP9
Sulfuric Acid SCHEMBL479725 0.81 CA1 (0.56) CA1CA2MMP1MMP2MMP9
Sulfuric Acid SCHEMBL11681409 0.80 CA1 (0.55) CA1CA2MMP1MMP2MMP9

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-5175261-A Useful for coloring cellulose materials, animal furs or leather IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-29 US disclosed