SCHEMBL9104596

SCHEMBL9104596

CCC(N1c2cc(C)ccc2Oc2cccc(C)c21)S(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 4/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 4/20 0.32
THRB P10828 1/20 0.32
TSHR P16473 3/20 0.32
LMNA P02545 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
USP2 O75604 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
TP53 P04637 3/20 0.31
POLB P06746 1/20 0.31
HTT P42858 2/20 0.31
HSD17B10 Q99714 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
SCHEMBL9103791 0.88 NR3C1 (0.32) P2RX4SMN1; SMN2ALDH1A1MAPTPOLB
SCHEMBL9104348 0.88 P2RX4 (0.40) P2RX4SMN1; SMN2MAPTTSHRLMNA
SCHEMBL9106158 0.87 P2RX4 (0.43) P2RX4KMT2ASMN1; SMN2MAPTNPSR1
SCHEMBL9100096 0.86 NR3C1 (0.34) ALDH1A1MAPTHTTHSD17B10
SCHEMBL9105388 0.84 P2RX4 (0.33) P2RX4TSHRLMNAMAPK1
SCHEMBL9105793 0.83 P2RX4 (0.33) P2RX4SMN1; SMN2ALDH1A1MAPTTSHR
SCHEMBL9105458 0.81 P2RX4 (0.38) P2RX4MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL9103609 0.80 P2RX4 (0.43) P2RX4SMN1; SMN2MAPTLMNANPSR1
SCHEMBL9101991 0.80 NR3C1 (0.33)
SCHEMBL9105616 0.78 BCHE (0.35) KMT2AALDH1A1MAPTTHRBTSHR

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