SCHEMBL5269405

SCHEMBL5269405

COCc1ccccc1C(CCN(C(C)C)C(C)C)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 6/20 0.51
CHRM2 P08172 5/20 0.51
CHRM1 P11229 4/20 0.51
HRH1 P35367 4/20 0.51
HTR2A P28223 3/20 0.51
CHRM5 P08912 2/20 0.51
SLC6A4 P31645 2/20 0.51
LMNA P02545 1/20 0.51
ESR1 P03372 1/20 0.51
CHRM4 P08173 1/20 0.51
MAPT P10636 1/20 0.51
KCNE1 P15382 1/20 0.51
PTGS1 P23219 1/20 0.51
HRH2 P25021 1/20 0.51
ADRA1A P35348 1/20 0.51
OPRK1 P41145 1/20 0.51
KCNQ1 P51787 1/20 0.51
KCNH2 Q12809 1/20 0.51
CACNA1C Q13936 1/20 0.51
SCN5A Q14524 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
SCHEMBL3927212 0.82 CHRM3 (0.57) CHRM3CHRM2CHRM1HRH1HTR2A
Hydrochloric Acid SCHEMBL5180488 0.81 CHRM3 (0.56) CHRM3CHRM2CHRM1HRH1HTR2A
SCHEMBL8858816 0.81 CHRM2 (0.55) CHRM3CHRM2CHRM1HRH1HTR2A
Diisopromine SCHEMBL25648 0.78 HRH1 (0.63) CHRM3CHRM2CHRM1HRH1HTR2A
SCHEMBL13980083 0.77 CHRM3 (0.67) CHRM3CHRM2CHRM1HRH1HTR2A
SCHEMBL2167561 0.77 CHRM3 (0.67) CHRM3CHRM2CHRM1HRH1HTR2A
Diisopromine SCHEMBL11582569 0.76 HRH1 (0.61) CHRM3CHRM2CHRM1HRH1HTR2A
SCHEMBL6939192 0.76 CHRM3 (0.72) CHRM3CHRM2CHRM1HRH1HTR2A
SCHEMBL4664069 0.76 CHRM3 (0.72) CHRM3CHRM2CHRM1HRH1HTR2A
SCHEMBL27530643 0.76 HRH1 (0.56) CHRM3CHRM2CHRM1HRH1HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101124197-A Substantially pure tolterodine tartrate and process for preparing thereof TEVA PHARMA (IL) 2008-02-13 CN disclosed
CN-101102995-A Preparation method of tolterodine tartrate TEVA PHARMA (IL) 2008-01-09 CN disclosed
EP-1843999-A1 PROCESS FOR PREPARING TOLTERODINE TARTRATE Teva Pharmaceutical Industries Ltd (IL) 2007-10-17 EP disclosed
EP-1836156-A1 SUBSTANTIALLY PURE TOLTERODINE TARTRATE AND PROCESS FOR PREPARING THEREOF Teva Gyogyszergyar Reszvenytarsasag (HU) 2007-09-26 EP disclosed
US-20060194876-A1 Substantially pure tolterodine tartrate and process for preparing thereof TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2006-08-31 US disclosed
US-20060194987-A1 Process for preparing tolterodine tartrate TEVA PHARMACEUTICALS USA, INC. 2006-08-31 US disclosed
WO-2006074478-A1 SUBSTANTIALLY PURE TOLTERODINE TARTRATE AND PROCESS FOR PREPARING THEREOF TEVA PHARMACEUTICALS USA, INC. (US) 2006-07-13 WO disclosed
WO-2006074479-A1 PROCESS FOR PREPARING TOLTERODINE TARTRATE TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2006-07-13 WO 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-20060194876-A1 Substantially pure tolterodine tartrate and process for preparing thereof CYP17A1, TPP1, THOP1 CHRM3 246/4885CHRM2 484/4885CHRM1 820/4885
US-20060194987-A1 Process for preparing tolterodine tartrate TACR1, CYP3A43, TKT CHRM3 178/4885CHRM2 716/4885CHRM1 1368/4885

“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.