SCHEMBL995978

SCHEMBL995978

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

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
RAB9A P51151 3/20 0.34
NPC1 O15118 2/20 0.34
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
KMT2A Q03164 1/20 0.34
RELA Q04206 1/20 0.34
ALDH1A1 P00352 3/20 0.33
EPHX1 P07099 1/20 0.33
POLB P06746 2/20 0.33
ACHE P22303 6/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL996323 0.85 EPHX2 (0.34) HRH2HRH1SMN1; SMN2RAB9ANPC1
SCHEMBL16054123 0.84 ALDH1A1 (0.36) TDP1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL16054684 0.81 ACHE (0.38) HRH2HRH1SMN1; SMN2RAB9ANPC1
SCHEMBL1000038 0.81 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ANPC1MAPTTP53
SCHEMBL16054820 0.80 HRH2 (0.40) HRH2HRH1KDM4ESMN1; SMN2RAB9A
SCHEMBL995315 0.74 ALDH1A1 (0.44) TDP1KDM4ESMN1; SMN2RAB9ANPC1
SCHEMBL996065 0.74 MAPK1 (0.49) SMN1; SMN2RAB9ANPC1MAPTTP53
SCHEMBL995866 0.72 PPARD (0.50) KDM4EKMT2AALDH1A1
SCHEMBL9067071 0.70 SMN1; SMN2 (0.58) TDP1HRH2HRH1SMN1; SMN2MAPT
SCHEMBL995981 0.70 ADAM17 (0.43) TDP1HRH2HRH1SMN1; SMN2RAB9A

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