SCHEMBL9105228

SCHEMBL9105228

Cc1ccc2c(c1)Sc1c(C)cccc1N2CCCS(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.47
MAPT P10636 8/20 0.41
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
POLB P06746 7/20 0.41
MMP13 P45452 4/20 0.41
TDP1 Q9NUW8 5/20 0.40
ALOX15 P16050 4/20 0.40
MAPK1 P28482 3/20 0.40
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
RAD52 P43351 2/20 0.40
CYP3A4 P08684 2/20 0.40
USP2 O75604 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 5/20 0.39
ALDH1A1 P00352 5/20 0.39
ALOX12 P18054 3/20 0.39
CASP1 P29466 3/20 0.39
HSD17B10 Q99714 3/20 0.39

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
SCHEMBL9100972 0.88 MEN1 (0.52) DRD3MAPTMEN1KMT2APOLB
SCHEMBL9102418 0.86 MAPT (0.53) DRD3MAPTMEN1KMT2APOLB
SCHEMBL9099987 0.85 MAPT (0.39) DRD3MAPTMEN1KMT2APOLB
SCHEMBL9102553 0.82 MAPT (0.43) DRD3MAPTMEN1KMT2APOLB
SCHEMBL9104049 0.82 MAPT (0.48) DRD3MAPTMEN1KMT2APOLB
SCHEMBL9102093 0.81 MAPT (0.49) DRD3MAPTMEN1KMT2APOLB
SCHEMBL9104151 0.79 MAPT (0.58) DRD3MAPTMEN1KMT2APOLB
SCHEMBL9102168 0.78 MAPT (0.42) DRD3MAPTMEN1KMT2APOLB
SCHEMBL9101001 0.76 MAPT (0.39) MAPTMEN1KMT2APOLBMMP13
SCHEMBL9104972 0.75 MEN1 (0.41) DRD3MAPTMEN1KMT2APOLB

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