SCHEMBL5368973

SCHEMBL5368973

N#Cc1cc(N2CC[C@H]3CC[C@@H](C2)N3)cnc1F

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 11/20 0.46
CHRNA3 P32297 11/20 0.46
CHRNB2 P17787 10/20 0.46
CHRNA4 P43681 10/20 0.46
RET P07949 1/20 0.35
AR P10275 3/20 0.34

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
SCHEMBL5379858 1.00 CHRNB4 (0.46) CHRNB4CHRNA3CHRNB2CHRNA4RET
SCHEMBL5379437 0.92 CHRNB2 (0.47) CHRNB4CHRNA3CHRNB2CHRNA4RET
SCHEMBL5371088 0.90 CHRNB2 (0.43) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL5375733 0.90 CHRNB2 (0.43) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL5388909 0.85 CHRNB2 (0.49) CHRNB4CHRNA3CHRNB2CHRNA4AR
SCHEMBL5379278 0.85 CHRNB2 (0.49) CHRNB4CHRNA3CHRNB2CHRNA4AR
SCHEMBL5379291 0.82 CHRNB2 (0.47) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL5379936 0.81 CHRNB2 (0.46) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL5375282 0.81 CHRNB2 (0.46) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL1652735 0.76 CHRNB2 (0.54) 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.