SCHEMBL9103393

SCHEMBL9103393

CCc1cccc2c1Sc1ccccc1N2C(CC)S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 1/20 0.39
BCHE P06276 11/20 0.37
MAPT P10636 2/20 0.37
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35
ATM Q13315 1/20 0.35
ACHE P22303 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
NOX1 Q9Y5S8 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 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
SCHEMBL9104568 0.92 BCHE (0.35) RAD52BCHEMAPTCYP2D6TSHR
SCHEMBL9106142 0.90 BCHE (0.36) RAD52BCHEMAPTCYP2D6TSHR
SCHEMBL9104016 0.89 RAD52 (0.36) RAD52BCHEMAPTNOX1GABRA1
SCHEMBL9100969 0.88 BCHE (0.38) BCHEMAPTCYP2D6TSHRCYP2C19
SCHEMBL9105686 0.88 MAPT (0.38) BCHEMAPTCYP2D6TSHRCYP2C19
SCHEMBL9102163 0.87 RAD52 (0.32) RAD52MAPTCYP2D6
SCHEMBL6276192 0.87 BCHE (0.47) BCHEMAPTCYP2D6TSHRCYP2C19
SCHEMBL9104229 0.86 BCHE (0.36) BCHEMAPTCYP2D6TSHRCYP2C19
SCHEMBL9101553 0.86 CYP2D6 (0.35) RAD52BCHEMAPTCYP2D6TSHR
SCHEMBL9100651 0.85 BCHE (0.40) BCHEMAPTCYP2D6TSHRCYP2C19

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