SCHEMBL9102580

SCHEMBL9102580

CCc1ccc2c(c1)N(C(CC)S(=O)(=O)O)c1c(CC)cccc1S2

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.39
BCHE P06276 3/20 0.32
MAPT P10636 2/20 0.32
RXFP1 Q9HBX9 1/20 0.31
ANPEP P15144 1/20 0.30
DPP4 P27487 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
NOX1 Q9Y5S8 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 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
SCHEMBL9103772 0.88 CYP2D6 (0.31) CYP2D6BCHEMAPTTSHRCYP2C19
SCHEMBL9101371 0.88 CYP2D6 (0.35) CYP2D6
SCHEMBL9100651 0.87 BCHE (0.40) CYP2D6BCHEMAPTNOX1TSHR
SCHEMBL9103899 0.86 S1PR2 (0.33) CYP2D6BCHEMAPT
SCHEMBL9100134 0.86 CYP2D6 (0.46) CYP2D6BCHEMAPTNPC1ALDH1A1
SCHEMBL9105582 0.86 RAD52 (0.32) ANPEPDPP4
SCHEMBL9102684 0.82 CYP2D6 (0.37) CYP2D6MAPTNPC1ALDH1A1LMNA
SCHEMBL9104016 0.81 RAD52 (0.36) BCHEMAPTANPEPDPP4NOX1
SCHEMBL9105532 0.81 BCHE (0.37) CYP2D6BCHEMAPTALDH1A1LMNA
SCHEMBL9105202 0.80 BCHE (0.38) CYP2D6BCHEMAPTALDH1A1MAPK1

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