SCHEMBL7246992

SCHEMBL7246992

CN(C(=O)NCC1CC1)C1C2CCC1CN(CCCS(=O)(=O)c1ccc(C#N)cc1)C2

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 4/20 0.38
HRH1 P35367 4/20 0.38
CXCR3 P49682 1/20 0.36
CYP19A1 P11511 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
HTR7 P34969 1/20 0.34
KDM1A O60341 4/20 0.34
CCR3 P51677 1/20 0.33
TAS2R14 Q9NYV8 1/20 0.33
SCN9A Q15858 2/20 0.33
SCN5A Q14524 1/20 0.33
CCR5 P51681 1/20 0.33
EGLN2 Q96KS0 1/20 0.33

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
SCHEMBL7243888 0.86 HTR7 (0.40) HRH2HRH1CYP19A1HRH3HTR7
SCHEMBL7245444 0.84 CCR3 (0.41) HRH2HRH1HRH3KDM1ACCR3
SCHEMBL7245277 0.84 POLB (0.45) HRH2HRH1HRH3KDM1A
SCHEMBL7244499 0.84 HRH2 (0.38) HRH2HRH1HRH3HTR7CCR3
SCHEMBL6093832 0.83 HRH2 (0.41) HRH2HRH1CXCR3CYP19A1HRH3
SCHEMBL7243245 0.82 HRH2 (0.44) HRH2HRH1HRH3
SCHEMBL7242827 0.82 CCR6 (0.44) HRH2HRH1HRH3
SCHEMBL7248462 0.82 HRH3 (0.39) HRH2HRH1CYP19A1HRH3HTR7
SCHEMBL7249954 0.81 HRH2 (0.39) HRH2HRH1CYP19A1HRH3HTR7
SCHEMBL7251178 0.81 HRH2 (0.38) HRH2HRH1CYP19A1HRH3HTR7

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-6559162-B2 Electrophysiological activity ASTRAZENECA AB (SE) 2003-05-06 US disclosed
EP-1244631-A1 NEW AZABICYCLOOCTANE DERIVATIVES USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2002-10-02 EP disclosed
US-20020137766-A1 Azabicyclooctane derivatives useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2002-09-26 US disclosed
WO-2001047893-A1 NEW AZABICYCLOOCTANE DERIVATIVES USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2001-07-05 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-20020137766-A1 Azabicyclooctane derivatives useful in the treatment of cardiac arrhythmias KCNH1, KCNH2, KCNH3 HRH2 321/4885HRH1 367/4885CXCR3 3114/4885

“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.