SCHEMBL9101400

SCHEMBL9101400

CCC(N1c2ccccc2Sc2cccc(-c3ncccc3Br)c21)S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.36
TP53 P04637 1/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
HDAC3 O15379 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
KMT2A Q03164 1/20 0.32
MAPT P10636 3/20 0.32
BCHE P06276 2/20 0.32
THRB P10828 1/20 0.32
POLB P06746 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
NOX1 Q9Y5S8 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL9104094 0.89 THRB (0.38) LMNAHDAC1HDAC6HDAC3FNTA
SCHEMBL9103994 0.89 LMNA (0.36) LMNATP53HDAC1HDAC6HDAC3
SCHEMBL9101787 0.89 LMNA (0.36) LMNAHDAC1HDAC6HDAC3FNTA
SCHEMBL9102715 0.87 HDAC6 (0.35) LMNAHDAC1HDAC6HDAC3FNTA
SCHEMBL9102277 0.85 LMNA (0.34) LMNAHDAC1HDAC6HDAC3FNTA
SCHEMBL9102813 0.84 BCHE (0.39) LMNAMAPTBCHEPOLBNOX1
SCHEMBL9100362 0.83 TP53 (0.33) LMNATP53KMT2ACA1CA2
SCHEMBL9100816 0.83 HDAC1 (0.33) LMNATP53HDAC1HDAC6HDAC3
SCHEMBL9099114 0.80 BCHE (0.33) LMNAFNTAFNTBMAPTBCHE
SCHEMBL9104578 0.80 FNTA (0.35) FNTAFNTBMAPTBCHEPOLB

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