SCHEMBL9103667

SCHEMBL9103667

CCCCc1cc(CCCC)c2c(c1)Sc1ccc(CCCC)cc1N2OS(=O)(=O)CCC

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.32
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
DRD3 P35462 2/20 0.32
HTR6 P50406 2/20 0.32
TRIM24 O15164 1/20 0.32
CA2 P00918 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
HPGD P15428 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 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
SCHEMBL9105626 0.92
SCHEMBL9106579 0.90 BCHE (0.37) HTR2ACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL9103910 0.89 TP53 (0.33) DRD2HTR2AHTR2CDRD3HTR6
SCHEMBL9101699 0.86 LMNA (0.34) DRD2HTR2AHTR2CDRD3HTR6
SCHEMBL9101390 0.85 CYP2D6 (0.33) CYP2D6
SCHEMBL9107660 0.84
SCHEMBL9105734 0.83 BCHE (0.39) HTR2ACYP2D6
SCHEMBL9100815 0.81 BCHE (0.34) HTR2ACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL9103786 0.80
SCHEMBL9100175 0.80

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