SCHEMBL9102618

SCHEMBL9102618

CCCS(=O)(=O)ON1c2ccccc2Sc2cc(CC)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.39
BCHE P06276 8/20 0.37
SNCA P37840 1/20 0.37
MEN1 O00255 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
CHRM3 P20309 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2C P28335 1/20 0.35
SLC6A4 P31645 1/20 0.35
DRD3 P35462 1/20 0.35
HTR2B P41595 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NOX1 Q9Y5S8 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 4/20 0.35
HTT P42858 1/20 0.35
ACHE P22303 1/20 0.35

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
SCHEMBL9100150 0.93 CYP2D6 (0.44) CYP2D6BCHENPSR1MAPTHTT
SCHEMBL9104555 0.92 BCHE (0.36) CYP2D6BCHESNCAMEN1ADRA2A
SCHEMBL9102705 0.91 CYP2D6 (0.35) CYP2D6KMT2AMAPTKDM4EALDH1A1
SCHEMBL9102746 0.90 BCHE (0.39) BCHESNCAMEN1ADRA2AADRA2B
SCHEMBL9547663 0.88 BCHE (0.45) BCHENOX1NPSR1MAPTHTT
SCHEMBL7519303 0.87 BCHE (0.44) BCHENOX1NPSR1MAPTHTT
SCHEMBL7519307 0.87 BCHE (0.44) BCHENOX1NPSR1MAPTHTT
SCHEMBL9102428 0.86 BCHE (0.41) CYP2D6BCHESNCAMEN1ADRA2A
SCHEMBL9102178 0.86 KDM4E (0.30) MAPTKDM4EALDH1A1F2VDR
SCHEMBL9102312 0.85 SNCA (0.45) BCHESNCAL3MBTL1MAPTACHE

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