SCHEMBL5345293

SCHEMBL5345293

CCCCC1CCN(CCCC(=O)c2oc3ccccc3c2C)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.62
DRD2 P14416 3/20 0.62
ADRA2A P08913 2/20 0.62
CHRM2 P08172 2/20 0.62
CHRM4 P08173 2/20 0.62
CHRM5 P08912 2/20 0.62
CHRM3 P20309 2/20 0.62
DRD4 P21917 2/20 0.62
ADRA1D P25100 2/20 0.62
ADRA1A P35348 2/20 0.62
ADRA1B P35368 2/20 0.62
HTR1A P08908 1/20 0.62
ADRA2B P18089 1/20 0.62
HRH1 P35367 1/20 0.62
DRD3 P35462 3/20 0.47
ADRA2C P18825 1/20 0.47
HTR2B P41595 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL5336943 0.80 HRH3 (0.51) CHRM1DRD2ADRA2ACHRM2CHRM4
SCHEMBL5345306 0.78 CHRM1 (0.61) CHRM1DRD2ADRA2ACHRM2CHRM4
SCHEMBL4509670 0.78 CHRM1 (0.72) CHRM1DRD2ADRA2ACHRM2CHRM4
SCHEMBL4504348 0.77 DRD2 (1.00) CHRM1DRD2ADRA2ACHRM2CHRM4
SCHEMBL31060842 0.77 DRD2 (1.00) CHRM1DRD2ADRA2ACHRM2CHRM4
SCHEMBL4510566 0.77 CHRM1 (0.74) CHRM1DRD2ADRA2ACHRM2CHRM4
Hydrochloric Acid SCHEMBL4171949 0.76 CHRM1 (1.00) CHRM1DRD2ADRA2ACHRM2CHRM4
SCHEMBL4493719 0.76 CHRM1 (0.77) CHRM1DRD2ADRA2ACHRM2CHRM4
SCHEMBL4499158 0.75 DRD2 (0.83) CHRM1DRD2ADRA2ACHRM2CHRM4
SCHEMBL4509346 0.75 CHRM1 (0.79) CHRM1DRD2ADRA2ACHRM2CHRM4

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-20050113357-A1 Muscarinic agonists ANDERSON CARL-MAGNUS A (DK) 2005-05-26 US claimed
US-20020037886-A1 Muscarinic agonists ACADIA PHARMACEUTICALS INC. 2002-03-28 US claimed
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
US-20020037886-A1 Muscarinic agonists ACADIA PHARMACEUTICALS INC. 2002-03-28 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 (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 2/4885DRD2 476/4885ADRA2A 27/4885
US-20070155795-A1 MUSCARINIC AGONISTS CHRM2, CHRM1, CHRM4 CHRM1 2/4885DRD2 476/4885ADRA2A 27/4885
US-20050113357-A1 Muscarinic agonists CHRM2, CHRM1, CHRM4 CHRM1 2/4885DRD2 476/4885ADRA2A 27/4885

“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.