SCHEMBL1784061

SCHEMBL1784061

Cc1c(C(=O)O)ccc(OCc2ccccc2)c1[C@H](CCN(C(C)C)C(C)C)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.46
CHRM2 P08172 3/20 0.45
CHRM1 P11229 3/20 0.45
MAPT P10636 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CHRM5 P08912 2/20 0.41
CHRM3 P20309 2/20 0.41
HRH1 P35367 2/20 0.41
LMNA P02545 1/20 0.41
ESR1 P03372 1/20 0.41
CHRM4 P08173 1/20 0.41
KCNE1 P15382 1/20 0.41
PTGS1 P23219 1/20 0.41
HRH2 P25021 1/20 0.41
HTR2A P28223 1/20 0.41
SLC6A4 P31645 1/20 0.41

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
SCHEMBL1809358 0.81 CHRM3 (0.55) CHRM2CHRM1MAPTCHRM5CHRM3
SCHEMBL1809355 0.81 CHRM3 (0.55) CHRM2CHRM1MAPTCHRM5CHRM3
SCHEMBL1783715 0.77 CHRM2 (0.56) PTGER1CHRM2CHRM1MAPTCHRM5
SCHEMBL723428 0.77 CHRM2 (0.56) PTGER1CHRM2CHRM1MAPTCHRM5
Hydrochloric Acid SCHEMBL597394 0.77 CHRM2 (0.55) PTGER1CHRM2CHRM1MAPTCHRM5
Hydrochloric Acid SCHEMBL597393 0.77 CHRM2 (0.55) PTGER1CHRM2CHRM1MAPTCHRM5
SCHEMBL5179157 0.74 CHRM2 (0.55) CHRM2CHRM1MAPTSMN1; SMN2CHRM5
SCHEMBL5179164 0.74 CHRM2 (0.55) CHRM2CHRM1MAPTSMN1; SMN2CHRM5
SCHEMBL14830850 0.74 LMNA (0.49) CHRM2CHRM1MAPTL3MBTL1TDP1
SCHEMBL15459396 0.74 CHRM2 (0.62) PTGER1CHRM2CHRM1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110124903-A1 SOLID STATE FORMS OF FESOTERODINE INTERMEDIATES ACTAVIS GROUP PTC EHF (IS) 2011-05-26 US claimed
US-20110124903-A1 SOLID STATE FORMS OF FESOTERODINE INTERMEDIATES ACTAVIS GROUP PTC EHF (IS) 2011-05-26 US disclosed
US-20100217034-A1 Process for the Preparation of Fesoterodine ACTAVIS GROUP PTC EHF (IS) 2010-08-26 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 (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-20100217034-A1 Process for the Preparation of Fesoterodine ADRB3, FES, QDPR PTGER1 3853/4885CHRM2 107/4885CHRM1 279/4885
US-20110124903-A1 SOLID STATE FORMS OF FESOTERODINE INTERMEDIATES FES, NISCH, RPS27A PTGER1 2625/4885CHRM2 530/4885CHRM1 646/4885

“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.