SCHEMBL9102684

SCHEMBL9102684

CCc1ccc2c(c1)Sc1ccc(CC)cc1N2C(CC)S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.37
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 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
SCHEMBL9102602 0.91 CYP2D6 (0.41) CYP2D6NPC1ALDH1A1LMNAMAPT
SCHEMBL9100134 0.91 CYP2D6 (0.46) CYP2D6NPC1ALDH1A1LMNAMAPT
SCHEMBL9100349 0.90 METAP2 (0.31)
SCHEMBL9101691 0.88 METAP2 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL9101371 0.86 CYP2D6 (0.35) CYP2D6
SCHEMBL9104043 0.84 HSD17B3 (0.31) CYP2D6NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9102163 0.82 RAD52 (0.32) CYP2D6NPC1ALDH1A1LMNAMAPT
SCHEMBL9102580 0.82 CYP2D6 (0.39) CYP2D6NPC1ALDH1A1LMNAMAPT
SCHEMBL9104535 0.82 BCHE (0.38) CYP2D6MAPT
SCHEMBL9100567 0.82 BCHE (0.38) CYP2D6MAPT

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