SCHEMBL5337712

SCHEMBL5337712

CCCCC1CCN(CCCC(=O)N(C)OC)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.51
CHRM2 P08172 2/20 0.51
CHRM4 P08173 2/20 0.51
CHRM5 P08912 2/20 0.51
DRD2 P14416 2/20 0.51
CHRM3 P20309 2/20 0.51
DRD4 P21917 2/20 0.51
ADRA1D P25100 2/20 0.51
ADRA1A P35348 2/20 0.51
ADRA1B P35368 2/20 0.51
HTR1A P08908 1/20 0.51
ADRA2A P08913 1/20 0.51
ADRA2B P18089 1/20 0.51
HRH1 P35367 1/20 0.51
HTR4 Q13639 7/20 0.43
ACHE P22303 5/20 0.43
HRH3 Q9Y5N1 1/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL5331529 0.84 MAPT (0.44) MEN1ALDH1A1CYP2D6CYP2C9KMT2A
SCHEMBL4497802 0.81 CHRM1 (0.55) CHRM1CHRM2CHRM4CHRM5DRD2
SCHEMBL4895254 0.77 PAOX (0.49) HTR1AADRA2AHRH3ALDH1A1CYP2D6
SCHEMBL4002137 0.75 GLA (0.45) ALDH1A1TSHR
SCHEMBL1327385 0.73 CHRM1 (0.52) CHRM1CHRM2CHRM4CHRM5DRD2
Acetic Acid SCHEMBL29252278 0.73 GNAO1 (0.59) CHRM1CHRM2CHRM4CHRM5DRD2
Acetic Acid SCHEMBL29252516 0.73 GNAO1 (0.59) CHRM1CHRM2CHRM4CHRM5DRD2
SCHEMBL4175236 0.73 FAAH (0.52) HPGD
SCHEMBL211903 0.73 ALDH1A1 (0.60) ALDH1A1POLB
Acetic Acid SCHEMBL29251905 0.72 CHRM1 (0.51) CHRM1CHRM2CHRM4CHRM5DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155795-A1 MUSCARINIC AGONISTS ACADIA PHARMACEUTICALS INC. (US) 2007-07-05 US disclosed
US-7238713-B2 Muscarinic agonists ACADIA PHARMACEUTICALS, INC. (US) 2007-07-03 US disclosed
EP-1535912-A1 Muscarinic agonists Arcadia Pharmaceuticals Inc. (US) 2005-06-01 EP disclosed
US-20050113357-A1 Muscarinic agonists ANDERSON CARL-MAGNUS A (DK) 2005-05-26 US disclosed
EP-1278741-B1 MUSCARINIC AGONISTS ACADIA PHARM INC (US) 2005-03-02 EP disclosed
US-6627645-B2 Cholinergic agents ACADIA PHARMACEUTICALS, INC. 2003-09-30 US disclosed
EP-1278741-A1 MUSCARINIC AGONISTS Acadia Pharmaceuticals Inc. (US) 2003-01-29 EP disclosed
US-20020037886-A1 Muscarinic agonists ACADIA PHARMACEUTICALS INC. 2002-03-28 US disclosed
WO-2001083472-A1 MUSCARINIC AGONISTS ACADIA PHARMACEUTICALS, INC. (US) 2001-11-08 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 (3 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-20020037886-A1 Muscarinic agonists CHRM2, CHRM1, CHRM4 CHRM1 2/4885CHRM2 1/4885CHRM4 3/4885
US-20070155795-A1 MUSCARINIC AGONISTS CHRM2, CHRM1, CHRM4 CHRM1 2/4885CHRM2 1/4885CHRM4 3/4885
US-20050113357-A1 Muscarinic agonists CHRM2, CHRM1, CHRM4 CHRM1 2/4885CHRM2 1/4885CHRM4 3/4885

“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.