SCHEMBL9105403

SCHEMBL9105403

CCCS(=O)(=O)ON1c2cccc(C)c2Oc2cccc(C)c21

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
P2RX4 Q99571 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
SCHEMBL9100971 0.91 P2RX4 (0.35) TSHRMAPK1P2RX4
SCHEMBL9104365 0.90 P2RX4 (0.38) TSHRMAPK1HSD17B10P2RX4
SCHEMBL9102006 0.89 NR3C1 (0.31)
SCHEMBL9100107 0.88 NR3C1 (0.32) HSD17B10
SCHEMBL9105106 0.84 KDM4E (0.31) KDM4E
SCHEMBL9104611 0.83 P2RX4 (0.35) TSHRMAPK1KDM4EHSD17B10P2RX4
SCHEMBL9105233 0.82 MAOA (0.30) KDM4E
SCHEMBL9102956 0.80
SCHEMBL9103561 0.79 KDM4E (0.34) KDM4EP2RX4
SCHEMBL9102681 0.78 MTNR1A (0.32)

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