SCHEMBL4874804

SCHEMBL4874804

O=C(O)C(=O)O[C@H]1CN2CCC1CC2

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 7/20 0.65
CHRM1 P11229 5/20 0.65
CYP2D6 P10635 2/20 0.65
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
CHRNA7 P36544 2/20 0.54
BCHE P06276 1/20 0.54
ACHE P22303 1/20 0.54
CHRM3 P20309 5/20 0.53
CHRM4 P08173 1/20 0.51
CHRM5 P08912 1/20 0.51
GLA P06280 1/20 0.50
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL4637799 1.00 CHRM2 (0.65) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL3743487 0.84 CHRM2 (0.69) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL1549648 0.84 CHRM2 (0.69) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL5171242 0.84 CHRM2 (0.69) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL3743481 0.82 CHRM2 (0.71) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL13470758 0.78 CHRM2 (0.67) CHRM2CHRM1CYP2D6MEN1KMT2A
(S)-Aceclidine SCHEMBL9146471 0.78 CHRM2 (1.00) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL21063805 0.78 CHRM2 (0.67) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL7399043 0.78 CHRM2 (0.67) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL7824053 0.78 CYP2D6 (0.62) CHRM2CHRM1CYP2D6CHRNA7BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214600-A1 Quaternized Quinuclidine Esters ALMIRALL PRODESFARMA, SA (ES) 2008-09-04 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-20080214600-A1 Quaternized Quinuclidine Esters NQO2, QPCT, QARS1 CHRM2 344/4885CHRM1 327/4885CYP2D6 104/4885

“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.