SCHEMBL9100359

SCHEMBL9100359

CCCc1ccc2c(c1)Sc1ccc(CCC)cc1N2CCCS(=O)(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
ALOX15 P16050 3/20 0.45
RAD52 P43351 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
TP53 P04637 2/20 0.45
CYP3A4 P08684 2/20 0.45
KDM4E B2RXH2 1/20 0.45
USP2 O75604 1/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
POLB P06746 2/20 0.42
MMP13 P45452 2/20 0.42
CYP2D6 P10635 5/20 0.41
KIF11 P52732 1/20 0.41
CYP1A2 P05177 4/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 3/20 0.39
LMNA P02545 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
SCHEMBL9101693 0.94 MAPT (0.45) MAPTALOX15RAD52TDP1TP53
SCHEMBL9100574 0.92 MAPT (0.54) MAPTALOX15RAD52TDP1TP53
SCHEMBL9104546 0.92 MEN1 (0.51) MAPTALOX15RAD52TDP1TP53
SCHEMBL9102691 0.91 MAPT (0.47) MAPTALOX15RAD52TDP1TP53
SCHEMBL9105725 0.86 MAPT (0.53) MAPTALOX15RAD52TDP1TP53
SCHEMBL9102733 0.86 MEN1 (0.50) MAPTALOX15RAD52TDP1TP53
SCHEMBL9105617 0.86 MAPT (0.38) MAPTALOX15RAD52TDP1TP53
SCHEMBL9103778 0.83 MAPT (0.41) MAPTALOX15RAD52TDP1TP53
SCHEMBL9104972 0.83 MEN1 (0.41) MAPTALOX15RAD52TDP1TP53
SCHEMBL9102609 0.82 MEN1 (0.53) MAPTALOX15RAD52TDP1TP53

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