SCHEMBL1701362

SCHEMBL1701362

O=C(O[C@H]1CN2CCC1CC2)[C@@H](Nc1ccc(F)cc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 11/20 0.57
CHRNA7 P36544 2/20 0.52
BCHE P06276 1/20 0.52
ACHE P22303 1/20 0.52
CHRM2 P08172 8/20 0.52
CHRM1 P11229 8/20 0.52
CHRM4 P08173 2/20 0.50
CHRM5 P08912 2/20 0.50
CYP2D6 P10635 1/20 0.49
KCNH2 Q12809 1/20 0.47

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
SCHEMBL1695689 1.00 CHRM3 (0.57) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL1695691 1.00 CHRM3 (0.57) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL1696148 1.00 CHRM3 (0.57) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL13240791 0.96 CHRNA7 (0.55) CHRM3CHRNA7BCHEACHECHRM2
Cadaverine Tartrate SCHEMBL16341929 0.95 CHRM3 (0.52) CHRM3CHRNA7BCHEACHECHRM2
Cadaverine Tartrate SCHEMBL15117460 0.95 CHRM3 (0.52) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL2487995 0.94 CHRM3 (0.48) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL2487991 0.94 CHRM3 (0.48) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL1695933 0.92 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL1695935 0.92 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2585459-B1 Alkaloid aminoester derivatives and medicinal compositions thereof CHIESI FARMA SPA (IT) 2015-01-07 EP disclosed
EP-2585459-B1 Alkaloid aminoester derivatives and medicinal compositions thereof CHIESI FARMA SPA (IT) 2015-01-07 EP disclosed
US-8492548-B2 Alkaloid aminoester derivatives and medicinal compositions thereof CHIESI FARMACEUTICI S.P.A. (IT) 2013-07-23 US disclosed
US-8492548-B2 Alkaloid aminoester derivatives and medicinal compositions thereof CHIESI FARMACEUTICI S.P.A. (IT) 2013-07-23 US disclosed
US-8492548-B2 Alkaloid aminoester derivatives and medicinal compositions thereof CHIESI FARMACEUTICI S.P.A. (IT) 2013-07-23 US disclosed
EP-2585459-A1 ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF Chiesi Farmaceutici S.p.A. (IT) 2013-05-01 EP disclosed
WO-2011161018-A1 ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2011-12-29 WO disclosed
WO-2011161018-A1 ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2011-12-29 WO disclosed
US-20110311458-A1 ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2011-12-22 US disclosed
US-20110311458-A1 ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2011-12-22 US disclosed
US-20110311458-A1 ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2011-12-22 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 (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-20110311458-A1 ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHRM3, CHRM5, CHRM2 CHRM3 1/4885CHRNA7 16/4885BCHE 29/4885

“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.