SCHEMBL3124705

SCHEMBL3124705

N#Cc1ccc(OCCN2CC3CN(CCCNS(=O)(=O)c4ccccc4)CC(C2)O3)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.60
HTR7 P34969 5/20 0.45
HRH2 P25021 5/20 0.45
HRH1 P35367 5/20 0.45
HTR1A P08908 3/20 0.45
ALDH1A1 P00352 1/20 0.45
MEN1 O00255 3/20 0.44
KCNA5 P22460 2/20 0.44
HRH3 Q9Y5N1 3/20 0.43
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL3126384 0.97 KCNH2 (0.63) KCNH2HTR7HRH2HRH1ALDH1A1
SCHEMBL3131043 0.94 KCNH2 (0.61) KCNH2HTR7HRH2HRH1HTR1A
SCHEMBL3120395 0.93 KCNH2 (0.68) KCNH2HRH2HRH1ALDH1A1MEN1
SCHEMBL3125321 0.90 KCNH2 (0.68) KCNH2HTR7HRH2HRH1HTR1A
SCHEMBL3131778 0.89 KCNH2 (0.65) KCNH2HRH2HRH1MEN1KCNA5
SCHEMBL3128803 0.88 KCNH2 (0.55) KCNH2HRH2HRH1ALDH1A1MEN1
SCHEMBL3126031 0.88 KCNH2 (0.72) KCNH2HRH2HRH1HRH3
SCHEMBL3131066 0.87 KCNH2 (0.71) KCNH2HTR7HRH2HRH1HTR1A
SCHEMBL3127820 0.87 KCNH2 (0.71) KCNH2HTR7HRH2HRH1ALDH1A1
SCHEMBL3123057 0.86 KCNH2 (0.54) KCNH2HTR7HTR1AHRH3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765832-A1 NOVEL OXABISPIDINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2007-03-28 EP claimed
WO-2005123748-A1 NOVEL OXABISPIDINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2005-12-29 WO claimed
US-7648985-B2 Oxabispidine compounds and their use in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2010-01-19 US disclosed
US-20090270383-A1 Novel Oxabispidine Compounds And Their Use In The Treatment Of Cardiac Arrhythmias ASTRAZENECA AB (SE) 2009-10-29 US disclosed
US-20090005558-A1 Novel Oxabispidine Compounds and Their Use in the Treatment of Cardiac Arrhythmias ASTRAZENECA AB (SE) 2009-01-01 US disclosed
EP-1765832-A1 NOVEL OXABISPIDINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2007-03-28 EP disclosed
WO-2005123748-A1 NOVEL OXABISPIDINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2005-12-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090270383-A1 Novel Oxabispidine Compounds And Their Use In The Treatment Of Cardiac Arrhythmias KCNH1, RYR1, CACNA1E KCNH2 8/4885HTR7 4429/4885HRH2 616/4885
US-20090005558-A1 Novel Oxabispidine Compounds and Their Use in the Treatment of Cardiac Arrhythmias KCNH1, RYR1, CACNA1E KCNH2 8/4885HTR7 4429/4885HRH2 616/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.