SCHEMBL9106101

SCHEMBL9106101

CCCS(=O)(=O)ON1c2ccccc2Oc2cccc(Cl)c21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 10/20 0.36
P2RX1 P51575 1/20 0.36
AHR P35869 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 1/20 0.32
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL9104785 0.89 AHR (0.38) P2RX4P2RX1AHRMEN1KMT2A
SCHEMBL9104365 0.86 P2RX4 (0.38) P2RX4P2RX1KMT2A
SCHEMBL9101934 0.86 P2RX4 (0.36) P2RX4P2RX1
SCHEMBL9104489 0.85 P2RX4 (0.43) P2RX4P2RX1HDAC3HDAC6
SCHEMBL9104487 0.85 P2RX4 (0.41) P2RX4P2RX1MEN1KMT2AHDAC3
SCHEMBL9102641 0.85 P2RX4 (0.36) P2RX4P2RX1MEN1KMT2A
SCHEMBL9102611 0.84 MEN1 (0.33) MEN1KMT2A
SCHEMBL9102996 0.84 P2RX4 (0.36) P2RX4P2RX1HDAC3HDAC6
SCHEMBL9104503 0.82 P2RX4 (0.35) P2RX4P2RX1
SCHEMBL9102754 0.81 PIM1 (0.44) P2RX4MEN1KMT2ACYP1A2CYP2C19

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