SCHEMBL997543

SCHEMBL997543

CC#CCOc1ccc(S(=O)(=O)N(C)CC(C(=O)O)(C(=O)O)N2CCN(S(C)(=O)=O)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 20/20 0.53
MMP13 P45452 9/20 0.53
MMP2 P08253 5/20 0.53
MMP8 P22894 3/20 0.53
MMP7 P09237 2/20 0.53
MMP1 P03956 5/20 0.52
MMP9 P14780 5/20 0.52
MMP14 P50281 1/20 0.49
ADAM10 O14672 1/20 0.45
MMP3 P08254 1/20 0.45
ADAM9 Q13443 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
SCHEMBL14245113 0.91 ADAM17 (0.52) ADAM17MMP13MMP2MMP8MMP7
SCHEMBL995893 0.82 ADAM17 (0.61) ADAM17MMP13MMP2MMP8MMP7
SCHEMBL14245046 0.79 ADAM17 (0.60) ADAM17MMP13MMP2MMP8MMP7
SCHEMBL995892 0.79 ADAM17 (0.36) ADAM17MMP13MMP2MMP1MMP9
SCHEMBL10276954 0.78 ADAM17 (0.61) ADAM17MMP13MMP2MMP1MMP9
SCHEMBL16460281 0.76 ADAM17 (0.50) ADAM17MMP13MMP2MMP8MMP7
SCHEMBL14244962 0.76 ADAM17 (0.60) ADAM17MMP13MMP2MMP8MMP7
SCHEMBL996097 0.75 ADAM17 (0.75) ADAM17MMP13MMP2MMP8MMP7
SCHEMBL14245112 0.74 ADAM17 (0.62) ADAM17MMP13MMP2MMP1MMP9
SCHEMBL6508472 0.73 ADAM17 (0.76) ADAM17MMP13MMP2MMP8MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2801568-A1 Benzene-sulphonamide compounds, method for synthesising and use in medicine and in cosmetics Galderma Research & Development (FR) 2014-11-12 EP disclosed
EP-2448920-B1 Benzenesulfonamide compounds, method for synthesizing same, and use thereof in medicine GALDERMA RES & DEV (FR) 2014-08-13 EP disclosed
EP-2448920-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS Galderma Research & Development (FR) 2012-05-09 EP disclosed
WO-2011001089-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-01-06 WO disclosed