SCHEMBL5334871

SCHEMBL5334871

CC1CCN(CCn2nnc3ccccc32)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 7/20 0.56
CYP2D6 P10635 1/20 0.52
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
P2RX7 Q99572 1/20 0.50
MAPT P10636 1/20 0.50
GLA P06280 1/20 0.49
TSHR P16473 1/20 0.49
EGLN3 Q9H6Z9 1/20 0.48
ACHE P22303 1/20 0.48
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 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
SCHEMBL5333845 0.92 SLC9A1 (0.58) SLC9A1CYP2D6NPC1RAB9AP2RX7
SCHEMBL5338055 0.92 SLC9A1 (0.61) SLC9A1P2RX7
SCHEMBL5337563 0.86 SLC9A1 (0.57) SLC9A1CYP2D6NPC1RAB9AP2RX7
SCHEMBL5336093 0.85 SLC9A1 (0.52) SLC9A1CYP2D6NPC1RAB9AP2RX7
SCHEMBL5334123 0.84 SLC9A1 (0.58) SLC9A1CYP2D6NPC1RAB9AP2RX7
SCHEMBL5335071 0.83 SLC9A1 (0.50) SLC9A1CYP2D6NPC1RAB9AP2RX7
SCHEMBL5331700 0.83 SLC9A1 (0.54) SLC9A1CYP2D6NPC1RAB9AP2RX7
SCHEMBL5340412 0.82 SLC9A1 (0.60) SLC9A1CYP2D6NPC1RAB9AP2RX7
SCHEMBL5335562 0.81 SLC9A1 (0.51) SLC9A1CYP2D6NPC1RAB9AP2RX7
SCHEMBL5337026 0.81 SLC9A1 (0.55) SLC9A1CYP2D6NPC1RAB9AP2RX7

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 8 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
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 SLC9A1 3562/4885CYP2D6 1003/4885NPC1 1418/4885
US-20070155795-A1 MUSCARINIC AGONISTS CHRM2, CHRM1, CHRM4 SLC9A1 3562/4885CYP2D6 1003/4885NPC1 1418/4885
US-20050113357-A1 Muscarinic agonists CHRM2, CHRM1, CHRM4 SLC9A1 3562/4885CYP2D6 1003/4885NPC1 1418/4885

“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.