SCHEMBL9104492

SCHEMBL9104492

CCCCc1cccc2c1N(C(CC)S(=O)(=O)O)c1ccccc1O2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 10/20 0.37
P2RX1 P51575 1/20 0.36
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
PIM1 P11309 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALOX5 P09917 1/20 0.30
PTGS2 P35354 1/20 0.30
LIPG Q9Y5X9 1/20 0.30
AGTR1 P30556 1/20 0.30
PRKCG P05129 1/20 0.30
PRKCB P05771 1/20 0.30
PRKCA P17252 1/20 0.30
PRKCH P24723 1/20 0.30
PRKCE Q02156 1/20 0.30
PRKCQ Q04759 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
SCHEMBL9102980 0.93 P2RX4 (0.39) P2RX4P2RX1PIM1MAPTSMN1; SMN2
SCHEMBL9102664 0.92 MTNR1A (0.33) P2RX4P2RX1NR1H2NR1H3
SCHEMBL9105156 0.90 P2RX4 (0.35) P2RX4P2RX1NR1H2NR1H3PIM1
SCHEMBL9101918 0.89 P2RX4 (0.40) P2RX4P2RX1PIM1MAPTSMN1; SMN2
SCHEMBL9104818 0.88 METAP2 (0.33) P2RX4P2RX1
SCHEMBL9103906 0.88 P2RX4 (0.35) P2RX4P2RX1PIM1MAPTSMN1; SMN2
SCHEMBL9101857 0.85 APLNR (0.32) NR1H2NR1H3
SCHEMBL9102934 0.85 P2RX4 (0.33) P2RX4P2RX1
SCHEMBL9107687 0.84
SCHEMBL9101943 0.83 P2RX4 (0.36) P2RX4P2RX1PIM1

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