SCHEMBL9101890

SCHEMBL9101890

CCCc1ccc2c(c1)Oc1ccc(CCC)cc1N2OS(=O)(=O)CCC

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.31
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30
ADRA1B P35368 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
SCHEMBL9100264 0.93 CA2 (0.33) CA2
SCHEMBL9107635 0.92 P2RX4 (0.34) ADRA1DADRA1AADRA1B
SCHEMBL9103982 0.92 P2RX4 (0.34) ADRA1DADRA1AADRA1B
SCHEMBL9102665 0.91 KDM4E (0.31) CA2
SCHEMBL9100480 0.85 ALDH1A1 (0.30)
SCHEMBL9104010 0.85 P2RX4 (0.36) CA2ADRA1DADRA1AADRA1B
SCHEMBL9102037 0.85 P2RX4 (0.36) CA2ADRA1DADRA1AADRA1B
SCHEMBL9106662 0.83 P2RX4 (0.35)
SCHEMBL9103987 0.83 P2RX4 (0.35)
SCHEMBL9104725 0.83

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