SCHEMBL9104348

SCHEMBL9104348

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

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 11/20 0.40
P2RX1 P51575 2/20 0.36
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PIM1 P11309 1/20 0.33
SIRT1 Q96EB6 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
LMNA P02545 1/20 0.32
P2RX3 P56373 1/20 0.32

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
SCHEMBL9105388 0.91 P2RX4 (0.33) P2RX4P2RX1TSHRMAPK1LMNA
SCHEMBL9100957 0.89 P2RX4 (0.39) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9104596 0.88 P2RX4 (0.35) P2RX4MAPTSMN1; SMN2NPSR1TSHR
SCHEMBL9105458 0.88 P2RX4 (0.38) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9101918 0.87 P2RX4 (0.40) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9106091 0.86 P2RX4 (0.39) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9102626 0.86 P2RX4 (0.39) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9102980 0.84 P2RX4 (0.39) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9103542 0.84 TP53 (0.33) P2RX4MAPTSMN1; SMN2LMNA
SCHEMBL9100096 0.83 NR3C1 (0.34) MAPT

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