SCHEMBL14477367

SCHEMBL14477367

CCOc1ccc2c(c1)CN(C(=O)OCc1ccccc1)CC2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 18/20 0.66
SIGMAR1 Q99720 18/20 0.66
HRH2 P25021 4/20 0.60
HTR2C P28335 4/20 0.60
HRH1 P35367 4/20 0.60
HTR1E P28566 3/20 0.60
HTR1A P08908 3/20 0.60
HTR2A P28223 3/20 0.60
HTR2B P41595 3/20 0.60
CHRM5 P08912 2/20 0.60
ADRA1D P25100 2/20 0.60
HTR1B P28222 2/20 0.60
SLC6A2 P23975 1/20 0.60
SLC6A3 Q01959 1/20 0.60
HRH3 Q9Y5N1 4/20 0.58
ADRA2A P08913 3/20 0.58
ADRA2B P18089 3/20 0.58
DRD3 P35462 2/20 0.58
CHRM4 P08173 1/20 0.56
ADRA1A P35348 1/20 0.56

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
SCHEMBL24229547 0.92 TMEM97 (0.66) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL6188639 0.89 TMEM97 (0.63) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL16173559 0.89 TMEM97 (0.62) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL6190050 0.89 TMEM97 (0.62) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL6187231 0.87 TMEM97 (0.60) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL1299851 0.85 TMEM97 (0.58) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL30515329 0.83 TMEM97 (0.70) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL1299903 0.83 TMEM97 (0.70) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL6190953 0.83 F10 (0.57) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL1300458 0.83 TMEM97 (0.60) TMEM97SIGMAR1HRH2HTR2CHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013001088-A1 DIRECT SYNTHESIS OF 18F-FLUOROMETHOXY COMPOUNDS FOR PET IMAGING AND THE PROVISION OF NEW PRECURSORS FOR DIRECT RADIOSYNTHESIS OF PROTECTED DERIVATIVES OF O-([18F]FLUOROMETHYL) TYROSINE PIRAMAL IMAGING SA (CH) 2013-01-03 WO disclosed