SCHEMBL9102536

SCHEMBL9102536

CCc1ccc2c(c1)N(CCCS(=O)(=O)O)c1c(CC)cccc1O2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.34
KMT2A Q03164 5/20 0.34
TDP1 Q9NUW8 3/20 0.34
PIM1 P11309 2/20 0.34
MAPT P10636 5/20 0.33
POLB P06746 2/20 0.33
MMP13 P45452 2/20 0.33
LMNA P02545 2/20 0.33
RAB9A P51151 1/20 0.32
HDAC3 O15379 3/20 0.31
HDAC6 Q9UBN7 3/20 0.31
TUBB4A P04350 2/20 0.31
TUBB P07437 2/20 0.31
TUBA3C P0DPH7 2/20 0.31
HDAC4 P56524 2/20 0.31
TUBA1B P68363 2/20 0.31
TUBA4A P68366 2/20 0.31
TUBB4B P68371 2/20 0.31
TUBB3 Q13509 2/20 0.31
HDAC1 Q13547 2/20 0.31

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
SCHEMBL9100223 0.89 MEN1 (0.33) MEN1KMT2ATDP1PIM1MAPT
SCHEMBL9104716 0.88 MEN1 (0.35) MEN1KMT2ATDP1PIM1MAPT
SCHEMBL9106656 0.87 MEN1 (0.46) MEN1KMT2ATDP1PIM1MAPT
SCHEMBL9104823 0.87 S1PR2 (0.35) MEN1KMT2ATDP1PIM1MAPT
SCHEMBL9101924 0.87 MEN1 (0.40) MEN1KMT2ATDP1PIM1MAPT
SCHEMBL9105470 0.86 MAPT (0.32) MEN1KMT2ATDP1MAPTPOLB
SCHEMBL9102657 0.84 MEN1 (0.37) MEN1KMT2ATDP1PIM1MAPT
SCHEMBL9107444 0.82 MEN1 (0.39) MEN1KMT2ATDP1PIM1MAPT
SCHEMBL9105223 0.81 MAPT (0.37) MEN1KMT2ATDP1MAPTPOLB
SCHEMBL9103976 0.81 SIGMAR1 (0.42) MEN1KMT2ATDP1PIM1MAPT

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