SCHEMBL9105473

SCHEMBL9105473

CCCS(=O)(=O)ON1c2ccccc2Oc2cc(C)cc(C)c21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 7/20 0.38
P2RX1 P51575 1/20 0.34
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
F2 P00734 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TP53 P04637 2/20 0.30
THRB P10828 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
SCHEMBL9103810 0.88 CA12 (0.31) P2RX4MAPTCA12CA2KDM4E
SCHEMBL9104365 0.88 P2RX4 (0.38) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9102006 0.87 NR3C1 (0.31) CA12CA2
SCHEMBL9103595 0.86 P2RX4 (0.35) P2RX4P2RX1MAPTCA12CA2
SCHEMBL9103621 0.84 P2RX4 (0.43) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9104487 0.82 P2RX4 (0.41) P2RX4P2RX1MAPTSMN1; SMN2NPSR1
SCHEMBL9104489 0.82 P2RX4 (0.43) P2RX4P2RX1KDM4E
SCHEMBL9106168 0.82 P2RX4 (0.43) P2RX4P2RX1MAPTKDM4EALDH1A1
SCHEMBL9104611 0.81 P2RX4 (0.35) P2RX4MAPTSMN1; SMN2NPSR1KDM4E
SCHEMBL9100107 0.81 NR3C1 (0.32) MAPTCA12CA2ALDH1A1

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