SCHEMBL9105514

SCHEMBL9105514

CCC(N1c2ccccc2Sc2cccc(C)c21)S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 14/20 0.41
CYP2D6 P10635 1/20 0.40
TSHR P16473 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPT P10636 2/20 0.40
ACHE P22303 1/20 0.40
NOX1 Q9Y5S8 1/20 0.39
GAA P10253 1/20 0.37
POLB P06746 1/20 0.37
ATM Q13315 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL9102550 0.89 BCHE (0.32) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9105616 0.88 BCHE (0.35) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9100651 0.88 BCHE (0.40) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9104955 0.87 BCHE (0.39) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL6276192 0.87 BCHE (0.47) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9102813 0.86 BCHE (0.39) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9100577 0.86 HDAC1 (0.42) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9100969 0.85 BCHE (0.38) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9105202 0.84 BCHE (0.38) BCHECYP2D6TSHRCYP2C19MAPT
SCHEMBL9103994 0.84 LMNA (0.36) BCHECYP2D6TSHRCYP2C19MAPT

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