SCHEMBL9106588

SCHEMBL9106588

CCCN1c2ccccc2Sc2cccc(-c3ccccn3)c21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 9/20 0.44
CYP2D6 P10635 3/20 0.40
CYP2C19 P33261 3/20 0.40
CYP1A2 P05177 2/20 0.40
HIF1A Q16665 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
CYP3A4 P08684 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
PDF Q9HBH1 1/20 0.39
LMNA P02545 3/20 0.38
SLC22A1 O15245 1/20 0.38
PRNP P04156 1/20 0.38
TP53 P04637 1/20 0.38
ADRB2 P07550 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
HTR1A P08908 1/20 0.38
CHRM5 P08912 1/20 0.38

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
SCHEMBL9104548 0.90 KDM1A (0.43) KDM1ACYP2D6CYP1A2HIF1AKDM4E
SCHEMBL9102120 0.87 KDM1A (0.46) KDM1ACYP2D6CYP2C19CYP1A2HIF1A
SCHEMBL9100603 0.83 MAOA (0.50) KDM1ACYP1A2HIF1AKDM4EMAPT
SCHEMBL9106477 0.79 HTR7 (0.37) CYP2D6CYP2C19CYP1A2HIF1AKDM4E
SCHEMBL9102202 0.76 KDM1A (0.45) KDM1ACYP2D6CYP1A2HIF1AKDM4E
SCHEMBL28043661 0.76 KDM1A (0.43) KDM1ACYP2D6CYP2C19CYP1A2HIF1A
SCHEMBL31123118 0.74 KDM1A (0.65) KDM1ACYP2D6CYP2C19CYP1A2HIF1A
SCHEMBL29795163 0.74 KDM1A (0.65) KDM1ACYP2D6CYP2C19CYP1A2HIF1A
SCHEMBL343282 0.74 KDM1A (0.65) KDM1ACYP2D6CYP2C19CYP1A2HIF1A
Ammonia Solution, Strong SCHEMBL5726715 0.73 KDM1A (0.62) KDM1ACYP2D6CYP2C19CYP1A2HIF1A

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