SCHEMBL7094723

SCHEMBL7094723

O=C(c1ccccc1)N1CC2CNCC(C2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 4/20 1.00
CHRNB4 P30926 4/20 1.00
CHRNA3 P32297 4/20 1.00
CHRNA4 P43681 4/20 1.00
CHRNA7 P36544 3/20 1.00

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
SCHEMBL584474 0.85 CHRNA4 (1.00) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL17953045 0.83 CHRNA4 (1.00) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL2031616 0.83 CHRNA4 (1.00) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL9636772 0.80 CHRNB2 (0.67) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL584402 0.78 CHRNA4 (0.74) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL10409323 0.78 CHRNA4 (0.64) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL14676930 0.77 CHRNB2 (0.71) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL6738910 0.76 CHRNB2 (0.61) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL6319408 0.76 CHRNB2 (0.61) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL12744721 0.75 CHRNB2 (0.60) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665014-B1 3-benzoyl-3,7-diazabicyclo(3,3,1)nonane anti-arrhythmic compounds SOLVAY PHARM GMBH (DE) 1997-09-03 EP claimed
US-5532251-A ANALGESICS AND CARDIOVASCULAR DISORDERS KALI-CHEMIE PHARMA GMBH (DE) 1996-07-02 US claimed
JP-7252152-A None JP disclosed
US-20160214983-A1 3,7-DIAZABICYCLO[3.3.1]NONANE CARBOXAMIDES AS ANTITHROMBOTIC AGENTS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-07-28 US disclosed
US-6602880-B2 3-phenyl-3,7-diazabicyclo[3.3.1] nonane compounds, process for preparing them, pharmaceutical compositions containing them and use thereof to inhibit cardiac arrhythmia SOLVAY PHARMACEUTICALS GMBH (DE) 2003-08-05 US disclosed
US-20030109541-A1 3-Phenyl-3,7-diazabicyclo[3.3.1] nonane compounds, process for preparing them, pharmaceutical compositions containing them and use thereof to inhibit cardiac arrhythmia SOLVAY PHARMACEUTICALS GMBH (DE) 2003-06-12 US disclosed
EP-0665014-B1 3-benzoyl-3,7-diazabicyclo(3,3,1)nonane anti-arrhythmic compounds SOLVAY PHARM GMBH (DE) 1997-09-03 EP disclosed
US-5532251-A ANALGESICS AND CARDIOVASCULAR DISORDERS KALI-CHEMIE PHARMA GMBH (DE) 1996-07-02 US disclosed
US-5532251-A ANALGESICS AND CARDIOVASCULAR DISORDERS KALI-CHEMIE PHARMA GMBH (DE) 1996-07-02 US disclosed
US-5532251-A ANALGESICS AND CARDIOVASCULAR DISORDERS KALI-CHEMIE PHARMA GMBH (DE) 1996-07-02 US disclosed
CN-1110556-A Pharmaceutical containg 3-benzoyl-3,7-diazabicydo [3.3.1]nonan compound KALI CHEMIE PHARMA GMBH (DE) 1995-10-25 CN disclosed
JP-H07252152-A ANTIARRHYTHMIC AGENT AND ITS PRODUCTION KALI CHEM PHARMA GMBH 1995-10-03 JP disclosed
EP-0665014-A1 3-benzoyl-3,7-diazabicyclo(3,3,1)nonane anti-arrhythmic compounds Kali-Chemie Pharma GmbH (DE) 1995-08-02 EP disclosed
EP-0665014-A1 3-benzoyl-3,7-diazabicyclo(3,3,1)nonane anti-arrhythmic compounds Kali-Chemie Pharma GmbH (DE) 1995-08-02 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 (2 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-20160214983-A1 3,7-DIAZABICYCLO[3.3.1]NONANE CARBOXAMIDES AS ANTITHROMBOTIC AGENTS TBXA2R, PDGFRA, TBXAS1 CHRNB2 2300/4885CHRNB4 2358/4885CHRNA3 701/4885
US-20030109541-A1 3-Phenyl-3,7-diazabicyclo[3.3.1] nonane compounds, process for preparing them, pharmaceutical compositions containing them and use thereof to inhibit cardiac arrhythmia SCN1B, KCNH1, SCN2B CHRNB2 1089/4885CHRNB4 1354/4885CHRNA3 770/4885

“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.