SCHEMBL9103561

SCHEMBL9103561

CCCS(=O)(=O)ON1c2ccccc2Oc2c(CC)cccc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
P2RX4 Q99571 5/20 0.33
P2RX1 P51575 1/20 0.33
MAOA P21397 1/20 0.32
MGLL Q99685 1/20 0.31
CTSB P07858 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
SCHEMBL9101955 0.93 KDM4E (0.33) KDM4EPOLBP2RX4P2RX1
SCHEMBL9105233 0.91 MAOA (0.30) KDM4EPOLBMAOA
SCHEMBL9105178 0.91 NR1H2 (0.33) KDM4EPOLBP2RX4P2RX1
SCHEMBL9101934 0.89 P2RX4 (0.36) KDM4EPOLBP2RX4P2RX1MAOA
SCHEMBL9100971 0.88 P2RX4 (0.35) P2RX4P2RX1
SCHEMBL9103488 0.87 KDM4E (0.30) KDM4E
SCHEMBL9103893 0.86 P2RX4 (0.33) P2RX4P2RX1
SCHEMBL9104785 0.86 AHR (0.38) KDM4EP2RX4P2RX1
SCHEMBL9106496 0.86 P2RX1 (0.31) KDM4EP2RX4P2RX1
SCHEMBL9104489 0.85 P2RX4 (0.43) KDM4EPOLBP2RX4P2RX1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9632034-B2 Fluorogenic and chromogenic substrate LI-COR, INC. (US) 2017-04-25 US disclosed
US-20160266045-A1 FLUOROGENIC AND CHROMOGENIC SUBSTRATE LI-COR, INC. (US) 2016-09-15 US disclosed
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