SCHEMBL21940909

SCHEMBL21940909

COC(C)(C)N1CCN(CCOCCOCCOCCO)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
HTR1A P08908 2/20 0.43
HTR7 P34969 3/20 0.37
CHRM2 P08172 2/20 0.36
ADRA2A P08913 2/20 0.36
DRD2 P14416 2/20 0.36
ADRA2B P18089 2/20 0.36
ADRA2C P18825 2/20 0.36
DRD4 P21917 2/20 0.36
HRH2 P25021 2/20 0.36
HTR2A P28223 2/20 0.36
ADRA1A P35348 2/20 0.36
HRH1 P35367 2/20 0.36
DRD3 P35462 2/20 0.36
OPRK1 P41145 2/20 0.36
HTR2B P41595 2/20 0.36
HTR6 P50406 2/20 0.36
KCNH2 Q12809 2/20 0.36
ABCB11 O95342 1/20 0.36
HTR5A P47898 1/20 0.36

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
SCHEMBL16219516 0.85 HTR1A (0.47) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A
SCHEMBL10294010 0.83 HTR1A (0.48) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A
SCHEMBL20466389 0.81 HTR1A (0.43) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A
SCHEMBL31305373 0.80 MEN1 (0.55) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A
SCHEMBL31305372 0.80 MEN1 (0.55) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A
SCHEMBL8966405 0.78
SCHEMBL4905012 0.78 HTR1A (0.54) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A
SCHEMBL14980281 0.77 HTR1A (0.51) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A
SCHEMBL18353898 0.77 HTR1A (0.51) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A
SCHEMBL13887619 0.76 HTR1A (0.48) SMN1; SMN2HTR1AHTR7CHRM2ADRA2A

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-11208655-B2 Functionally-modified oligonucleotides and subunits thereof SAREPTA THERAPEUTICS, INC. (US) 2021-12-28 US disclosed
US-20200115709-A1 Functionally-Modified Oligonucleotides And Subunits Thereof JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2020-04-16 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 (2 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-11208655-B2 Functionally-modified oligonucleotides and subunits thereof RTCB, NSUN3, NSUN2 SMN1; SMN2 203/4885HTR1A 4675/4885HTR7 4364/4885
US-20200115709-A1 Functionally-Modified Oligonucleotides And Subunits Thereof RTCB, NSUN3, NSUN2 SMN1; SMN2 203/4885HTR1A 4675/4885HTR7 4364/4885

“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.