SCHEMBL7248290

SCHEMBL7248290

COc1ccc(OC(CCCN2CC3CCC(C2)C3N(C)C(=O)O)c2ccc(C#N)cc2)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.43
SLC6A4 P31645 4/20 0.43
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
CCR5 P51681 2/20 0.36
MCHR1 Q99705 1/20 0.35
HRH2 P25021 3/20 0.35
HRH1 P35367 3/20 0.35
CXCR3 P49682 1/20 0.35
CACNA1B Q00975 1/20 0.35
SLC6A2 P23975 2/20 0.35
CYP2D6 P10635 1/20 0.35
NOS2 P35228 1/20 0.35
DRD3 P35462 2/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
CACNA1F O60840 1/20 0.34
HTR1A P08908 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
DRD2 P14416 1/20 0.34

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
SCHEMBL7248003 0.91 HRH3 (0.41) HRH3SLC6A4PPARDPPARACCR5
SCHEMBL7628144 0.90 HRH3 (0.40) HRH3SLC6A4PPARDPPARACCR5
SCHEMBL7244323 0.90 HRH3 (0.40) HRH3SLC6A4PPARDPPARACCR5
SCHEMBL7250187 0.87 HRH3 (0.40) HRH3SLC6A4PPARDPPARAMCHR1
SCHEMBL7242638 0.87 MGLL (0.39) HRH3SLC6A4MCHR1DRD3DRD2
SCHEMBL7244049 0.85 HRH3 (0.42) HRH3SLC6A4PPARDPPARAMCHR1
SCHEMBL6093345 0.85 HRH3 (0.42) HRH3SLC6A4PPARDPPARAMCHR1
SCHEMBL7248543 0.85 HRH3 (0.40) HRH3SLC6A4PPARDPPARAMCHR1
SCHEMBL7245539 0.85 SLC6A4 (0.43) HRH3SLC6A4MCHR1MEN1CACNA1C
SCHEMBL7243485 0.83 HRH3 (0.40) HRH3SLC6A4PPARDPPARACCR5

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 742/4885SLC6A4 4858/4885PPARD 3875/4885

“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.