SCHEMBL7242597

SCHEMBL7242597

CN(C(=O)OC(C)(C)CO)C1C2CCC1CN(CCCNc1ccc(C#N)cc1)C2

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.38
AR P10275 3/20 0.35
HRH2 P25021 4/20 0.35
HRH1 P35367 4/20 0.35
HRH3 Q9Y5N1 3/20 0.35
PDK2 Q15119 5/20 0.35
MEN1 O00255 2/20 0.35
CYP2D6 P10635 1/20 0.35
OPRK1 P41145 1/20 0.35
KCNH2 Q12809 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 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
SCHEMBL7243876 0.92 CCR3 (0.38) CCR3ARHRH2HRH1HRH3
SCHEMBL7244769 0.90 CCR3 (0.37) CCR3ARHRH2HRH1HRH3
SCHEMBL7245194 0.85 HRH3 (0.39) CCR3HRH2HRH1HRH3MEN1
SCHEMBL7248406 0.84 HRH2 (0.37) HRH2HRH1HRH3PDK2MEN1
SCHEMBL7252505 0.84 CYP2D6 (0.41) CCR3ARHRH2HRH1HRH3
SCHEMBL7243339 0.84 HRH2 (0.44) HRH2HRH1HRH3MEN1
SCHEMBL7245391 0.83 HRH2 (0.39) CCR3HRH2HRH1HRH3MEN1
SCHEMBL7242815 0.83 CCR3 (0.41) CCR3ARHRH2HRH1HRH3
SCHEMBL6093467 0.83 HRH2 (0.37) CCR3ARHRH2HRH1HRH3
SCHEMBL7244486 0.82 CCR3 (0.36) CCR3ARHRH2HRH1HRH3

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 CCR3 2275/4885AR 2213/4885HRH2 321/4885

“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.