SCHEMBL7250454

SCHEMBL7250454

CC(C)S(=O)(=O)N(C)C1C2CCC1CN(CCOc1ccc(C#N)cc1)C2

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.46
HRH2 P25021 14/20 0.46
HRH1 P35367 14/20 0.46
KCNH2 Q12809 1/20 0.42
KCNA5 P22460 2/20 0.40
SLC6A4 P31645 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL7245870 0.82 HRH2 (0.45) HRH3HRH2HRH1KCNA5MEN1
SCHEMBL7252155 0.81 KCNA5 (0.48) HRH3HRH2HRH1KCNA5MEN1
SCHEMBL7243497 0.81 HRH2 (0.43) HRH3HRH2HRH1KCNA5MEN1
SCHEMBL7245697 0.80 FNTA (0.42) HRH3HRH2HRH1
SCHEMBL7245961 0.80 HRH2 (0.45) HRH3HRH2HRH1KCNH2KCNA5
SCHEMBL7245492 0.79 KDM4E (0.47) HRH3HRH2HRH1KCNH2MEN1
SCHEMBL7678378 0.79 HRH2 (0.41) HRH3HRH2HRH1KCNA5
SCHEMBL7245291 0.79 HRH3 (0.48) HRH3HRH2HRH1
SCHEMBL7251579 0.79 ADRA1A (0.42) HRH3HRH2HRH1KCNA5
SCHEMBL7249141 0.78 KCNA5 (0.44) HRH3HRH2HRH1KCNH2KCNA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6559162-B2 Electrophysiological activity ASTRAZENECA AB (SE) 2003-05-06 US disclosed
US-20020137766-A1 Azabicyclooctane derivatives useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2002-09-26 US 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.