SCHEMBL9103635

SCHEMBL9103635

CCCCc1cc(CCCC)c2c(c1)Oc1ccc(CCCC)cc1N2CCCS(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
MMP13 P45452 1/20 0.31
KMT2A Q03164 1/20 0.31
DRD2 P14416 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
DRD3 P35462 1/20 0.30
HTR6 P50406 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
SCHEMBL9100474 0.93 MEN1 (0.32) MEN1POLBMAPTMMP13KMT2A
SCHEMBL9103912 0.90 SIGMAR1 (0.37) MEN1POLBMAPTMMP13KMT2A
SCHEMBL9104823 0.90 S1PR2 (0.35) S1PR2S1PR1S1PR3MEN1POLB
SCHEMBL9100252 0.86 S1PR2 (0.36) S1PR2S1PR1S1PR3MEN1POLB
SCHEMBL9100223 0.85 MEN1 (0.33) MEN1POLBMAPTMMP13KMT2A
SCHEMBL9103489 0.84 MEN1 (0.34) S1PR2S1PR1S1PR3MEN1POLB
SCHEMBL9104003 0.83 MEN1 (0.43) S1PR2S1PR1S1PR3MEN1POLB
SCHEMBL9104716 0.82 MEN1 (0.35) S1PR2S1PR1S1PR3MEN1POLB
SCHEMBL9102607 0.82 SIGMAR1 (0.38) MEN1POLBMAPTMMP13KMT2A
SCHEMBL9107692 0.82 S1PR2 (0.33) S1PR2S1PR1S1PR3MEN1POLB

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