SCHEMBL4377909

SCHEMBL4377909

Cc1ccccc1OC(CCN(C)C(=O)Oc1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.51
CYP1A2 P05177 3/20 0.51
CYP3A4 P08684 3/20 0.51
SLC6A2 P23975 3/20 0.51
CHRM1 P11229 2/20 0.51
TSHR P16473 2/20 0.51
ADRA2B P18089 2/20 0.51
HTR2A P28223 2/20 0.51
HTR2C P28335 2/20 0.51
SLC6A4 P31645 2/20 0.51
HRH1 P35367 2/20 0.51
OPRM1 P35372 2/20 0.51
DRD3 P35462 2/20 0.51
OPRK1 P41145 2/20 0.51
HTR2B P41595 2/20 0.51
SLC6A3 Q01959 2/20 0.51
KCNH2 Q12809 2/20 0.51
KLF10 Q13118 2/20 0.51
HRH3 Q9Y5N1 2/20 0.51
TP53 P04637 1/20 0.51

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
SCHEMBL12208533 0.89 ACHE (0.58) CYP2D6CYP1A2CYP3A4SLC6A2CHRM1
SCHEMBL27661428 0.87 CYP1A2 (0.52) CYP2D6CYP1A2CYP3A4SLC6A2CHRM1
SCHEMBL7429997 0.86 CYP2D6 (0.57) CYP2D6CYP1A2CYP3A4SLC6A2CHRM1
SCHEMBL5280197 0.86 CYP2D6 (0.57) CYP2D6CYP1A2CYP3A4SLC6A2CHRM1
SCHEMBL4942842 0.85 CYP2D6 (0.56) CYP2D6CYP1A2CYP3A4SLC6A2CHRM1
SCHEMBL27661331 0.84 CYP1A2 (0.49) CYP2D6CYP1A2CYP3A4SLC6A2CHRM1
SCHEMBL5268496 0.82 SLC6A9 (0.63) SLC6A4HRH3SLC6A9
Oxalic Acid SCHEMBL5033726 0.81 CYP1A2 (0.57) CYP2D6CYP1A2CYP3A4SLC6A2CHRM1
SCHEMBL25336202 0.81 SLC6A9 (0.41) CYP2D6SLC6A9ALDH1A1MAPTCYP2C9
SCHEMBL3894545 0.79 CYP2D6 (0.64) CYP2D6CYP1A2CYP3A4SLC6A2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009141833-A2 AN IMPROVED PROCESS FOR SYNTHESIZING HIGHLY PURE ATOMOXETINE IND-SWIFT LABORATORIES LIMITED (IN) 2009-11-26 WO claimed
US-20070270483-A1 PROCESS FOR THE PREPARATION OF ARYLOXYPROPYLAMINES DIPHARMA FRANCIS S.R.L. (IT) 2007-11-22 US claimed
EP-1857435-A2 A process for the preparation of aryloxypropylamines Dipharma Francis S.r.l. (IT) 2007-11-21 EP claimed
WO-2009141833-A2 AN IMPROVED PROCESS FOR SYNTHESIZING HIGHLY PURE ATOMOXETINE IND-SWIFT LABORATORIES LIMITED (IN) 2009-11-26 WO disclosed
WO-2009141833-A2 AN IMPROVED PROCESS FOR SYNTHESIZING HIGHLY PURE ATOMOXETINE IND-SWIFT LABORATORIES LIMITED (IN) 2009-11-26 WO disclosed
US-20070270483-A1 PROCESS FOR THE PREPARATION OF ARYLOXYPROPYLAMINES DIPHARMA FRANCIS S.R.L. (IT) 2007-11-22 US disclosed
EP-1857435-A2 A process for the preparation of aryloxypropylamines Dipharma Francis S.r.l. (IT) 2007-11-21 EP 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-20070270483-A1 PROCESS FOR THE PREPARATION OF ARYLOXYPROPYLAMINES NAT1, C1S, PAH CYP2D6 86/4885CYP1A2 22/4885CYP3A4 162/4885

“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.