SCHEMBL6274848

SCHEMBL6274848

O=S(=O)(c1ccccc1)N1CC2CNCC(C2)C1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.50
CHRNB4 P30926 1/20 0.50
CHRNA3 P32297 1/20 0.50
CHRNA7 P36544 1/20 0.50
CHRNA4 P43681 1/20 0.50
CYP2C9 P11712 1/20 0.47
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
PKM P14618 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
SCHEMBL1914984 0.84 BPTF (0.52) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL14704709 0.84 BPTF (0.52) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL28762510 0.84 BPTF (0.52) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL1711174 0.84 CYP2C9 (0.45) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
Hydrochloric Acid SCHEMBL23091800 0.83 BPTF (0.50) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL4776900 0.80 CYP2C9 (0.47) CYP2C9POLBL3MBTL1ALDH1A1RAB9A
SCHEMBL12207380 0.78 CYP2C9 (0.57) CYP2C9POLBL3MBTL1ALDH1A1RAB9A
SCHEMBL9635205 0.76 TSHR (0.45) CYP2C9POLBL3MBTL1ALDH1A1KMT2A
SCHEMBL19051706 0.74 POLB (0.70) CYP2C9POLBL3MBTL1ALDH1A1KMT2A
SCHEMBL17304912 0.74 CYP2C9 (0.52) CYP2C9POLBL3MBTL1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665228-B1 Pharmaceutical compositions containing 3-phenylsulfonyl-3,7-diazabicyclo 3,3,1 nonanes SOLVAY PHARM GMBH (DE) 1999-07-14 EP claimed
US-5576327-A Treatment of heart rhythym disorders by administration of 3-phenylsulfonyl-3, 7-diazabicyclo[3.3.1]nonane compounds KALI-CHEMIE PHARMA GMBH (DE) 1996-11-19 US claimed
JP-7267954-A None JP disclosed
JP-2005232179-A ANTIARRYTHMIC AGENT CONTAINING 3-PHENYLSULFONYL-3,7-DIAZABICYCLO[3,3,1]NONANE COMPOUND SOLVAY PHARMACEUT GMBH 2005-09-02 JP disclosed
JP-2005232179-A ANTIARRYTHMIC AGENT CONTAINING 3-PHENYLSULFONYL-3,7-DIAZABICYCLO[3,3,1]NONANE COMPOUND SOLVAY PHARMACEUT GMBH 2005-09-02 JP 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
US-5635511-A ACID ADDITION SALT DERIVATIVES; ANTIARRHYTHMIA AGENTS; ACTIVE SUPPRESSION OF EXTRASYSTOLES, VENTRICULAR FLUTTERS AND FIBRILLATIONS KALI-CHEMIE PHARMA GMBH (DE) 1997-06-03 US disclosed
US-5635511-A ACID ADDITION SALT DERIVATIVES; ANTIARRHYTHMIA AGENTS; ACTIVE SUPPRESSION OF EXTRASYSTOLES, VENTRICULAR FLUTTERS AND FIBRILLATIONS KALI-CHEMIE PHARMA GMBH (DE) 1997-06-03 US disclosed
US-5635511-A ACID ADDITION SALT DERIVATIVES; ANTIARRHYTHMIA AGENTS; ACTIVE SUPPRESSION OF EXTRASYSTOLES, VENTRICULAR FLUTTERS AND FIBRILLATIONS KALI-CHEMIE PHARMA GMBH (DE) 1997-06-03 US disclosed
US-5576327-A Treatment of heart rhythym disorders by administration of 3-phenylsulfonyl-3, 7-diazabicyclo[3.3.1]nonane compounds KALI-CHEMIE PHARMA GMBH (DE) 1996-11-19 US disclosed
US-5576327-A Treatment of heart rhythym disorders by administration of 3-phenylsulfonyl-3, 7-diazabicyclo[3.3.1]nonane compounds KALI-CHEMIE PHARMA GMBH (DE) 1996-11-19 US disclosed
US-5576327-A Treatment of heart rhythym disorders by administration of 3-phenylsulfonyl-3, 7-diazabicyclo[3.3.1]nonane compounds KALI-CHEMIE PHARMA GMBH (DE) 1996-11-19 US disclosed
JP-H07267954-A NOVEL 3-PHENYLSULFONYL-3,7-DIAZABICYCLO(3,3,1)NONANE COMPOUND, PRODUCTION THEREOF AND ANTIARRYTHMIC AGENT KALI CHEM PHARMA GMBH 1995-10-17 JP disclosed
EP-0665228-A1 Pharmaceutical compositions containing 3-phenylsulfonyl-3,7-diazabicyclo 3,3,1 nonanes 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 (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-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.