SCHEMBL9102665

SCHEMBL9102665

CCCS(=O)(=O)ON1c2ccc(CC)cc2Oc2ccc(CC)cc21

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
F2 P00734 1/20 0.30
MAPT P10636 1/20 0.30
VDR P11473 1/20 0.30
CA12 O43570 1/20 0.30
CA2 P00918 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
SCHEMBL9103987 0.91 P2RX4 (0.35) KDM4EALDH1A1LMNAF2MAPT
SCHEMBL9101890 0.91 CA2 (0.31) CA2
SCHEMBL9106662 0.91 P2RX4 (0.35) KDM4EALDH1A1LMNAF2MAPT
SCHEMBL9100264 0.89 CA2 (0.33) CA2
SCHEMBL9100231 0.86
SCHEMBL9105807 0.84 P2RX4 (0.33) GAACA12CA2
SCHEMBL9102548 0.83 MAPT (0.30) KDM4EALDH1A1F2MAPTVDR
SCHEMBL9103982 0.83 P2RX4 (0.34)
SCHEMBL9107635 0.83 P2RX4 (0.34)
SCHEMBL9103488 0.82 KDM4E (0.30) KDM4EALDH1A1F2MAPTVDR

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