SCHEMBL9103791

SCHEMBL9103791

CCC(N1c2cc(C)ccc2Oc2cc(C)cc(C)c21)S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 3/20 0.32
NR3C2 P08235 3/20 0.32
PGR P06401 2/20 0.32
POLB P06746 2/20 0.32
MAPT P10636 1/20 0.32
HTR2A P28223 2/20 0.31
P2RX4 Q99571 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HTR2C P28335 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
SCHEMBL9105458 0.88 P2RX4 (0.38) NR3C1NR3C2PGRMAPTP2RX4
SCHEMBL9104596 0.88 P2RX4 (0.35) POLBMAPTP2RX4ALDH1A1SMN1; SMN2
SCHEMBL9105793 0.85 P2RX4 (0.33) MAPTHTR2AP2RX4ALDH1A1SMN1; SMN2
SCHEMBL9101991 0.84 NR3C1 (0.33) NR3C1NR3C2PGR
SCHEMBL9106158 0.82 P2RX4 (0.43) MAPTP2RX4SMN1; SMN2
SCHEMBL9100096 0.79 NR3C1 (0.34) NR3C1NR3C2PGRMAPTALDH1A1
SCHEMBL9103609 0.77 P2RX4 (0.43) MAPTP2RX4SMN1; SMN2
SCHEMBL9107461 0.77 NR3C1 (0.32) NR3C1NR3C2PGR
SCHEMBL9104348 0.76 P2RX4 (0.40) MAPTP2RX4SMN1; SMN2
SCHEMBL9103583 0.75 P2RX4 (0.36) NR3C1NR3C2PGRP2RX4

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