SCHEMBL5334930

SCHEMBL5334930

CCCCC1CCN(CCCc2noc3ccccc23)CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.67
HRH3 Q9Y5N1 1/20 0.51
HTR2A P28223 12/20 0.51
HTR2C P28335 1/20 0.51
ADRA1A P35348 1/20 0.51
ADRA1B P35368 1/20 0.51
DRD2 P14416 11/20 0.50
HTR7 P34969 11/20 0.50
HTR6 P50406 11/20 0.50

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
SCHEMBL5334026 0.84 ACHE (0.50) ACHEHTR2AHTR2CADRA1AADRA1B
SCHEMBL5343113 0.81 ACHE (0.55) ACHEHTR2AHTR2CADRA1AADRA1B
SCHEMBL5341884 0.81 ACHE (0.49) ACHEHTR2AHTR2CADRA1AADRA1B
SCHEMBL6986882 0.81 ACHE (1.00) ACHE
SCHEMBL5332159 0.80 FAAH (0.59) ACHEHRH3ADRA1AADRA1BDRD2
SCHEMBL5335431 0.78 ACHE (0.54) ACHEHTR2AHTR2CADRA1AADRA1B
SCHEMBL5334230 0.78 DRD2 (0.52) HRH3HTR2AADRA1AADRA1BDRD2
SCHEMBL5340506 0.78 ACHE (0.48) ACHEHTR2AHTR2CADRA1AADRA1B
SCHEMBL5336943 0.77 HRH3 (0.51) ACHEHRH3ADRA1AADRA1BDRD2
SCHEMBL5331696 0.77 HRH3 (0.51) ACHEHRH3ADRA1AADRA1BDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1535912-A1 Muscarinic agonists Arcadia Pharmaceuticals Inc. (US) 2005-06-01 EP claimed
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
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 ACHE 22/4885HRH3 42/4885HTR2A 235/4885
US-20070155795-A1 MUSCARINIC AGONISTS CHRM2, CHRM1, CHRM4 ACHE 22/4885HRH3 42/4885HTR2A 235/4885
US-20050113357-A1 Muscarinic agonists CHRM2, CHRM1, CHRM4 ACHE 22/4885HRH3 42/4885HTR2A 235/4885

“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.