SCHEMBL995979

SCHEMBL995979

CCCCOC(=O)NOC(=O)C(C)N1CCN(S(C)(=O)=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
HRH2 P25021 2/20 0.39
HRH1 P35367 2/20 0.39
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 5/20 0.34
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 4/20 0.34
KMT2A Q03164 2/20 0.34
TP53 P04637 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
EPHX1 P07099 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ADAM17 P78536 1/20 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
SCHEMBL996324 0.87 EPHX2 (0.35) HRH2HRH1SMN1; SMN2NPC1RAB9A
SCHEMBL16054124 0.84 KDM4E (0.39) TDP1KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL16054933 0.81 HRH2 (0.41) HRH2HRH1KDM4ESMN1; SMN2NPC1
SCHEMBL1000039 0.81 SMN1; SMN2 (0.49) SMN1; SMN2NPC1RAB9AL3MBTL1HPGD
SCHEMBL16054685 0.81 SIGMAR1 (0.38) HRH2HRH1SMN1; SMN2NPC1RAB9A
SCHEMBL995981 0.75 ADAM17 (0.43) TDP1HRH2HRH1SMN1; SMN2NPC1
SCHEMBL995317 0.74 ALDH1A1 (0.44) NPC1RAB9AHPGDKMT2ATP53
SCHEMBL30406525 0.74 TP53 (0.46) TDP1KDM4ESMN1; SMN2KMT2ATP53
SCHEMBL996067 0.74 MAPK1 (0.49) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL11598616 0.73 ALDH1A1 (0.47) TDP1KDM4ESMN1; SMN2NPC1RAB9A

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-2968314-A2 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS Galderma Research & Development (FR) 2016-01-20 EP disclosed
WO-2014140861-A2 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-09-18 WO 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