SCHEMBL5375748

SCHEMBL5375748

Clc1ccc(N2C[C@H]3CN[C@H](C3)C2)cn1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 8/20 0.68
CHRNA3 P32297 8/20 0.68
CHRNB2 P17787 11/20 0.64
CHRNA4 P43681 11/20 0.64
CHRNA7 P36544 1/20 0.44

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
SCHEMBL5379807 1.00 CHRNB4 (0.68) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA7
SCHEMBL5380140 0.84 CHRNB2 (0.62) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA7
SCHEMBL5372742 0.84 CHRNB2 (0.62) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA7
SCHEMBL5034151 0.83 CHRNB4 (0.64) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA7
SCHEMBL5369152 0.80 CHRNB2 (0.61) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL5384777 0.80 CHRNB2 (0.61) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL6187620 0.79 CHRNB2 (0.63) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA7
SCHEMBL5376103 0.78 CHRNB2 (1.00) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL5377608 0.78 CHRNB2 (0.63) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL5388877 0.78 CHRNB2 (0.51) CHRNB4CHRNA3CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030225268-A1 Diazabicyclic CNS active agents ABBVIE INC. 2003-12-04 US claimed
EP-1359152-A2 Diazabicyclic derivatives as nicotinic acetylcholine receptor ligands ABBOTT LABORATORIES (US) 2003-11-05 EP claimed
US-7265115-B2 Diazabicyclic CNS active agents ABBOTT LABORATORIES (US) 2007-09-04 US disclosed
US-20030225268-A1 Diazabicyclic CNS active agents ABBVIE INC. 2003-12-04 US disclosed
EP-1359152-A2 Diazabicyclic derivatives as nicotinic acetylcholine receptor ligands ABBOTT LABORATORIES (US) 2003-11-05 EP 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-20030225268-A1 Diazabicyclic CNS active agents GABRE, GRIN1, CNTN1 CHRNB4 37/4885CHRNA3 23/4885CHRNB2 29/4885

“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.