SCHEMBL9104801

SCHEMBL9104801

CCC(N1c2ccccc2Sc2ccc(Cl)cc21)S(=O)(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 2/20 0.47
KDM4E B2RXH2 2/20 0.47
TP53 P04637 2/20 0.47
CYP3A4 P08684 2/20 0.47
MAPT P10636 2/20 0.47
MAPK1 P28482 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
USP2 O75604 1/20 0.47
ALOX15 P16050 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
BCHE P06276 3/20 0.46
ACHE P22303 3/20 0.46
CYP2D6 P10635 2/20 0.46
KIF11 P52732 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ITGB2 P05107 1/20 0.45
ICAM1 P05362 1/20 0.45
ITGAL P20701 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL9102298 0.93 SNCA (0.47) RAD52KDM4ETP53CYP3A4MAPT
SCHEMBL6276192 0.88 BCHE (0.47) MAPTBCHEACHECYP2D6CYP2C19
SCHEMBL9104147 0.86 BCHE (0.41) CYP3A4MAPTBCHEACHECYP2D6
SCHEMBL9100134 0.85 CYP2D6 (0.46) MAPTMAPK1L3MBTL1BCHEACHE
SCHEMBL9100922 0.85 BCHE (0.42) MAPTMAPK1TDP1L3MBTL1BCHE
SCHEMBL9100567 0.83 BCHE (0.38) MAPTBCHEACHECYP2D6CYP2C19
SCHEMBL9105686 0.81 MAPT (0.38) MAPTMAPK1BCHEACHECYP2D6
SCHEMBL9102414 0.81 BCHE (0.41) CYP3A4MAPTBCHEACHECYP2D6
SCHEMBL9105723 0.81 BCHE (0.39) MAPTBCHECYP2D6KDM1AADRB3
SCHEMBL9100285 0.81 BCHE (0.42) MAPTL3MBTL1BCHEACHECYP2D6

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