SCHEMBL1619397

SCHEMBL1619397

N#Cc1ccc(OCCCN2CC3CNCC(C2)O3)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.50
HRH2 P25021 9/20 0.49
HRH1 P35367 9/20 0.49
KCNH2 Q12809 1/20 0.48
KDM1A O60341 1/20 0.39
USP30 Q70CQ3 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL15163479 0.94 HRH3 (0.44) HRH3HRH2HRH1KCNH2KDM1A
Hydrochloric Acid SCHEMBL1618281 0.94 HRH3 (0.43) HRH3HRH2HRH1KCNH2KDM1A
Hydrochloric Acid SCHEMBL3122612 0.94 HRH3 (0.43) HRH3HRH2HRH1KCNH2KDM1A
SCHEMBL3124752 0.85 KCNH2 (0.48) HRH3HRH2HRH1KCNH2KDM1A
Hydrochloric Acid SCHEMBL3132895 0.84 KCNH2 (0.47) HRH3HRH2HRH1KCNH2KDM1A
SCHEMBL4669350 0.83 KCNH2 (0.49) HRH3HRH2HRH1KCNH2USP30
SCHEMBL4130153 0.83 KCNH2 (0.51) HRH3HRH2HRH1KCNH2USP30
SCHEMBL4133463 0.83 KCNH2 (0.54) HRH3HRH2HRH1KCNH2USP30
SCHEMBL1619064 0.83 HRH3 (0.70) HRH3HRH2HRH1KCNH2MEN1
SCHEMBL2964313 0.82 HRH3 (0.43) HRH3HRH2HRH1KCNH2KDM1A

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-7928225-B2 Oxabispidine compounds for the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2011-04-19 US disclosed
US-20090054422-A1 New Oxabispidine Compounds For The Treatment Of Cardiac Arrhythmias ASTRAZENECA AB (SE) 2009-02-26 US disclosed
EP-1893619-A1 NEW OXABISPIDINE COMPOUNDS FOR THE TREATMENT OF CARDIAC ARRHYTMIAS AstraZeneca AB (SE) 2008-03-05 EP disclosed
WO-2006135316-A1 New oxabispidine compounds for the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2006-12-21 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 (1 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-20090054422-A1 New Oxabispidine Compounds For The Treatment Of Cardiac Arrhythmias RYR1, KCNH1, CACNA1E HRH3 448/4885HRH2 521/4885HRH1 484/4885

“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.