SCHEMBL7243646

SCHEMBL7243646

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

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.38
HRH2 P25021 9/20 0.38
HRH1 P35367 9/20 0.38
HTR7 P34969 1/20 0.36
CYP19A1 P11511 1/20 0.35
KCNH2 Q12809 1/20 0.34
MEN1 O00255 1/20 0.33
CCR6 P51684 1/20 0.32

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
SCHEMBL6094059 0.86 HRH2 (0.42) HRH3HRH2HRH1HTR7CYP19A1
SCHEMBL7244499 0.84 HRH2 (0.38) HRH3HRH2HRH1HTR7MEN1
SCHEMBL7242820 0.83 HRH3 (0.40) HRH3HRH2HRH1HTR7CYP19A1
SCHEMBL7249360 0.83 HRH3 (0.46) HRH3HRH2HRH1
SCHEMBL7248462 0.82 HRH3 (0.39) HRH3HRH2HRH1HTR7CYP19A1
SCHEMBL7033710 0.81 HRH2 (0.38) HRH3HRH2HRH1HTR7CYP19A1
SCHEMBL5965605 0.80 HRH2 (0.38) HRH3HRH2HRH1HTR7KCNH2
SCHEMBL2958755 0.80 KCNH2 (0.42) HRH3HRH2HRH1HTR7CYP19A1
SCHEMBL7243888 0.78 HTR7 (0.40) HRH3HRH2HRH1HTR7CYP19A1
SCHEMBL7248526 0.78 NSD2 (0.40) HRH3HRH2HRH1HTR7CYP19A1

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 HRH3 742/4885HRH2 321/4885HRH1 367/4885

“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.