SCHEMBL1636459

SCHEMBL1636459

Cn1nc(C(=O)N2CCN3CCC2CC3)c2ccc(Br)cc21

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.44
UGCG Q16739 8/20 0.42
CHRNA3 P32297 2/20 0.41
HTR3A P46098 1/20 0.39
RBP4 P02753 1/20 0.38
SCD5 Q86SK9 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL1634971 0.86 UGCG (0.42) CHRNA7UGCGHTR3ARBP4ALDH1A1
SCHEMBL1635170 0.81 CHRNA7 (0.39) CHRNA7UGCGCHRNA3
SCHEMBL1635365 0.79 TNKS (0.37) CHRNA7UGCGHTR3ARBP4ALDH1A1
SCHEMBL1572751 0.78 CHRNA7 (0.45) CHRNA7UGCGCHRNA3HTR3ASCD5
SCHEMBL1636659 0.77 QPCT (0.44) UGCGHTR3A
SCHEMBL4232915 0.74 GSK3B (0.46) CHRNA7UGCGCHRNA3RBP4
SCHEMBL492125 0.73 PDGFRA (0.47) HTR3AALDH1A1
SCHEMBL492961 0.73 CHRNA7 (0.50) CHRNA7HTR3AALDH1A1CYP3A4TSHR
SCHEMBL1636745 0.71 UGCG (0.48) CHRNA7UGCGCHRNA3HTR3ARBP4
SCHEMBL4028569 0.70 CHRNA7 (0.62) CHRNA7CHRNA3HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932248-B2 3-(1,4-Diazabicyclo[3.2.2]non-4-ylcarbonyl)-5-(tetrahydro-2H-pyran-4-yloxy)-1H-indazole,nicotinic receptor agonists; particularly ligands for the nicotinic alpha-7-receptor(alpha 7 nAChR subtype); brain disorders; neuroprotectants; strokes; antiischemic agents; glutamate-induced excitotoxicity MEMORY PHARMACEUTICALS CORPORATION (US) 2011-04-26 US disclosed
US-20070135417-A1 3-(1,4-Diazabicyclo[3.2.2]non-4-ylcarbonyl)-5-(tetrahydro-2H-pyran-4-yloxy)-1H-indazole,nicotinic receptor agonists; particularly ligands for the nicotinic alpha-7-receptor(alpha 7 nAChR subtype); brain disorders; neuroprotectants; strokes; antiischemic agents; glutamate-induced excitotoxicity MEMORY PHARMACEUTICALS CORPORATION 2007-06-14 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-20070135417-A1 3-(1,4-Diazabicyclo[3.2.2]non-4-ylcarbonyl)-5-(tetrahydro-2H-pyran-4-yloxy)-1H-indazole,nicotinic receptor agonists; particularly ligands for the nicotinic alpha-7-receptor(alpha 7 nAChR subtype); brain disorders; neuroprotectants; strokes; antiischemic agents; glutamate-induced excitotoxicity CHRNA7, CHRNA5, CHRNA3 CHRNA7 1/4885UGCG 3702/4885CHRNA3 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.