SCHEMBL9105866

SCHEMBL9105866

CCCCc1cccc2c1N(C(CC)S(=O)(=O)O)c1ccccc1S2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 13/20 0.39
CYP2D6 P10635 2/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
GFER P55789 1/20 0.37
POLB P06746 2/20 0.36
ATM Q13315 1/20 0.36
MAPT P10636 2/20 0.36
ACHE P22303 2/20 0.36
NOX1 Q9Y5S8 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM1A O60341 1/20 0.34
GAA P10253 1/20 0.34
CHRM2 P08172 2/20 0.33
HTR1A P08908 2/20 0.33
CHRM1 P11229 2/20 0.33
DRD3 P35462 2/20 0.33
HRH3 Q9Y5N1 2/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 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
SCHEMBL9105202 0.93 BCHE (0.38) BCHECYP2D6TSHRCYP2C19POLB
SCHEMBL9102133 0.90 BCHE (0.31) BCHE
SCHEMBL9100651 0.90 BCHE (0.40) BCHECYP2D6TSHRCYP2C19POLB
SCHEMBL9103899 0.89 S1PR2 (0.33) BCHECYP2D6POLBATMMAPT
SCHEMBL9106570 0.87 BCHE (0.36) BCHECYP2D6TSHRCYP2C19GFER
SCHEMBL9106142 0.87 BCHE (0.36) BCHECYP2D6TSHRCYP2C19GFER
SCHEMBL9102277 0.86 LMNA (0.34) BCHEGFERMAPT
SCHEMBL9100161 0.83 S1PR2 (0.30)
SCHEMBL9104783 0.83 RAD52 (0.31) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9100410 0.83 BCHE (0.32) BCHEGFERMAPTNOX1

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
US-8192948-B1 Chemifluorescent substrate for peroxide and peroxidase detection PIERCE BIOTECHNOLOGY, INC. (US) 2012-06-05 US disclosed
EP-0361470-B1 Method for the chemiluminescence assay of the activity of peroxidase FUJIREBIO KK (JP) 1993-12-22 EP disclosed
US-5171668-A Measuring light emitted from contacting (iso)luminol, peroxide, peroxidase activity enhancer, such as indoanilines, phenolindophenol and N-methylphenothiazine, with labeled peroxidase antibody-antigen complex FUJIREBIO INC. (JP) 1992-12-15 US disclosed
EP-0361470-A2 Method for the chemiluminescence assay of the activity of peroxidase FUJIREBIO INC. (JP) 1990-04-04 EP disclosed