SCHEMBL9105617

SCHEMBL9105617

CCCc1cc(CCC)c2c(c1)Sc1ccc(CCC)cc1N2CCCS(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.38
TDP1 Q9NUW8 4/20 0.38
ALOX15 P16050 3/20 0.38
RAD52 P43351 3/20 0.38
MAPK1 P28482 3/20 0.38
CYP3A4 P08684 2/20 0.38
TP53 P04637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
POLB P06746 4/20 0.37
MMP13 P45452 4/20 0.37
HPGD P15428 4/20 0.35
HSD17B10 Q99714 3/20 0.35
LMNA P02545 3/20 0.35
ALDH1A1 P00352 3/20 0.35
ALOX12 P18054 2/20 0.35
CASP1 P29466 2/20 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
SCHEMBL9103660 0.93 MAPT (0.38) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9100805 0.90 MEN1 (0.48) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9103778 0.89 MAPT (0.41) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9101381 0.86 MAPT (0.40) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9100359 0.86 MAPT (0.45) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9099252 0.84 MAPT (0.38) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9100574 0.83 MAPT (0.54) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9106574 0.82 MEN1 (0.47) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9103903 0.82 MAPT (0.41) MAPTTDP1ALOX15RAD52MAPK1
SCHEMBL9101693 0.81 MAPT (0.45) MAPTTDP1ALOX15RAD52MAPK1

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