SCHEMBL6406080

SCHEMBL6406080

CN(C=O)c1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 6/20 0.59
ALDH1A1 P00352 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.48
KDM4E B2RXH2 1/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
KEAP1 Q14145 1/20 0.48
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
KIF11 P52732 2/20 0.46
PGR P06401 1/20 0.43
MAPT P10636 2/20 0.42
CYP2C9 P11712 1/20 0.42
MAPK1 P28482 1/20 0.40
GFER P55789 1/20 0.40
MCL1 Q07820 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL10926948 0.80 CA1 (0.68) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL12054668 0.77 KEAP1 (0.75) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
Hydrochloric Acid SCHEMBL9048426 0.76 NR3C2 (0.61) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL14358638 0.75 CA1 (0.56) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL14358641 0.75 CA1 (0.56) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL28397545 0.75 NR3C2 (0.59) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL18160763 0.75 LMNA (0.52) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL6406076 0.74 NR3C2 (0.59) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL9479877 0.74 NR3C2 (1.00) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E
Hydrochloric Acid SCHEMBL8531195 0.73 CA1 (0.36) NR3C2ALDH1A1SMN1; SMN2LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050130251-A1 Reagent for determination of hydrogen peroxide KYOWA MEDEX CO., LTD. (JP) 2005-06-16 US disclosed
EP-1424554-A1 REAGENT FOR DETERMINING HYDROGEN PEROXIDE KYOWA MEDEX CO., LTD. (JP) 2004-06-02 EP disclosed