SCHEMBL9106570

SCHEMBL9106570

CCCCc1cc(CCCC)c2c(c1)Sc1ccccc1N2C(CC)S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCHE P06276 12/20 0.36
ADRB3 P13945 1/20 0.34
HRH2 P25021 1/20 0.34
ADRA1D P25100 1/20 0.34
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
GFER P55789 1/20 0.34
MAPT P10636 2/20 0.34
POLB P06746 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
NOX1 Q9Y5S8 1/20 0.33
KDM1A O60341 1/20 0.32
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
ACHE P22303 2/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL9100797 0.92 BCHE (0.35) BCHEMAPTPOLBATMNPSR1
SCHEMBL9103659 0.90 METAP2 (0.31) HTR2A
SCHEMBL9107646 0.88
SCHEMBL9105866 0.87 BCHE (0.39) BCHEHRH2HTR2ASLC6A4SLC6A3
SCHEMBL9105532 0.86 BCHE (0.37) BCHEMAPTPOLBATMNPSR1
SCHEMBL9101706 0.86 BCHE (0.34) BCHEADRB3HRH2ADRA1DHTR2A
SCHEMBL9102726 0.85 BCHE (0.39) BCHEADRB3HRH2ADRA1DHTR2A
SCHEMBL9105723 0.83 BCHE (0.39) BCHEADRB3HRH2ADRA1DHTR2A
SCHEMBL9103899 0.83 S1PR2 (0.33) BCHEMAPTPOLBATMCYP2D6
SCHEMBL9100161 0.82 S1PR2 (0.30)

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