SCHEMBL9105392

SCHEMBL9105392

Cc1cccc2c1Oc1cccc(C)c1N2CCCS(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.35
MAPT P10636 9/20 0.35
HPGD P15428 7/20 0.35
POLB P06746 6/20 0.35
TDP1 Q9NUW8 5/20 0.35
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
MMP13 P45452 4/20 0.35
MAPK1 P28482 3/20 0.35
ALPG P10696 2/20 0.35
HSD17B10 Q99714 5/20 0.33
ALOX15 P16050 4/20 0.33
ALOX12 P18054 3/20 0.33
CASP1 P29466 2/20 0.33
PKM P14618 1/20 0.33
LMNA P02545 1/20 0.33
CASP7 P55210 1/20 0.33
L3MBTL1 Q9Y468 3/20 0.32
CYP3A4 P08684 2/20 0.32
CTDSP1 Q9GZU7 1/20 0.32

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
SCHEMBL9100967 0.90 SIGMAR1 (0.38) ALDH1A1MAPTHPGDPOLBTDP1
SCHEMBL9101998 0.90 MAPT (0.35) ALDH1A1MAPTHPGDPOLBTDP1
SCHEMBL9104354 0.89 P2RX4 (0.41) ALDH1A1MAPTHPGDPOLBTDP1
SCHEMBL9100103 0.88 ALDH1A1 (0.34) ALDH1A1MAPTHPGDPOLBTDP1
SCHEMBL9105101 0.83 POLB (0.35) ALDH1A1MAPTHPGDPOLBTDP1
SCHEMBL9104604 0.82 GAA (0.38) ALDH1A1MAPTHPGDPOLBMAPK1
SCHEMBL9105223 0.81 MAPT (0.37) ALDH1A1MAPTHPGDPOLBTDP1
SCHEMBL9102942 0.79 MAPT (0.35) ALDH1A1MAPTHPGDPOLBTDP1
SCHEMBL9102674 0.78 MTNR1A (0.35) ALDH1A1MAPTHPGDPOLBTDP1
SCHEMBL9105464 0.77 P2RX4 (0.40) ALDH1A1MAPTHPGDPOLBTDP1

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