SCHEMBL9102626

SCHEMBL9102626

CCC(N1c2ccccc2Oc2cccc(Br)c21)S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 11/20 0.39
P2RX1 P51575 2/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PIM1 P11309 1/20 0.33
HDAC3 O15379 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
P2RX3 P56373 1/20 0.31
PDE4B Q07343 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL9103879 0.89 P2RX4 (0.38) P2RX4P2RX1MEN1KMT2AMAPT
SCHEMBL9101918 0.86 P2RX4 (0.40) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9104348 0.86 P2RX4 (0.40) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9106091 0.85 P2RX4 (0.39) P2RX4P2RX1MEN1KMT2AMAPT
SCHEMBL9100362 0.84 TP53 (0.33) P2RX4MEN1KMT2APDE4B
SCHEMBL9102980 0.83 P2RX4 (0.39) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9101896 0.81 AHR (0.39) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9099173 0.81 AHR (0.39) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9102261 0.81 P2RX4 (0.33) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9104492 0.81 P2RX4 (0.37) P2RX4P2RX1MEN1KMT2AMAPT

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