SCHEMBL4201895

SCHEMBL4201895

O=C(NC1CN2CCC1CC2)c1ccc(-c2ccncc2)s1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 19/20 0.79
HTR3A P46098 8/20 0.79
HTR3E A5X5Y0 7/20 0.79
HTR3B O95264 7/20 0.79
HTR3D Q70Z44 7/20 0.79
HTR3C Q8WXA8 7/20 0.79
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HDAC5 Q9UQL6 1/20 0.54

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
SCHEMBL4207143 1.00 CHRNA7 (0.79) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL4201891 1.00 CHRNA7 (0.79) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL4195124 0.88 CHRNA7 (1.00) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL372893 0.88 CHRNA7 (1.00) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL4194893 0.88 CHRNA7 (1.00) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL6806889 0.88 CHRNA7 (1.00) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL4200197 0.88 CHRNA7 (0.78) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL4194858 0.88 CHRNA7 (0.78) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL4207665 0.88 CHRNA7 (0.78) CHRNA7HTR3AHTR3EHTR3BHTR3D
Hydrochloric Acid SCHEMBL7061150 0.87 CHRNA7 (0.98) CHRNA7HTR3AHTR3EHTR3BHTR3D

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1545537-B9 ALPHA-7 NICOTINIC RECEPTOR AGONISTS AND STATINS IN COMBINATION ASTRAZENECA AB (SE) 2008-08-20 EP claimed
US-7214688-B2 Compounds ASTRAZENECA AB (SE) 2007-05-08 US claimed
EP-1545537-B1 ALPHA-7 NICOTINIC RECEPTOR AGONISTS AND STATINS IN COMBINATION ASTRAZENECA AB (SE) 2007-04-04 EP claimed
US-20060128749-A1 Compounds PHILLIPS EIFION 2006-06-15 US claimed
US-20050256146-A1 Alpha-7 nicotinic receptor agonists and stains in combination ASTRAZENECA AB (SE) 2005-11-17 US claimed
EP-1545537-A1 ALPHA-7 NICOTINIC RECEPTOR AGONISTS AND STATINS IN COMBINATION AstraZeneca AB (SE) 2005-06-29 EP claimed
US-20040259909-A1 Treatment of fibromyalgia syndrome ASTRAZENECA AB (SE) 2004-12-23 US claimed
WO-2004019947-A1 ALPHA-7 NICOTINIC RECEPTOR AGONISTS AND STATINS IN COMBINATION ASTRAZENECA AB (SE) 2004-03-11 WO claimed
EP-1259508-B1 NOVEL BIARYLCARBOXAMIDES ASTRAZENECA AB (SE) 2003-10-15 EP claimed
US-20030008867-A1 Compounds ASTRAZENECA AB (SE) 2003-01-09 US claimed
EP-1259508-A1 NOVEL BIARYLCARBOXAMIDES AstraZeneca AB (SE) 2002-11-27 EP claimed
WO-2001060821-A1 NOVEL BIARYLCARBOXAMIDES ASTRAZENECA AB (SE) 2001-08-23 WO claimed
US-20090192180-A1 Alpha-7 Nicotinic Receptor Agonists and Statins In Combination KEITH RICHARD 2009-07-30 US disclosed
US-7491734-B2 2-(pyridine-4-yl)-N-(quinuclidin-2-yl)thiazole-4-carboxide nicotinic acetylcholine receptor ligands ASTRAZENECA AB (SE) 2009-02-17 US disclosed
EP-1545537-B9 ALPHA-7 NICOTINIC RECEPTOR AGONISTS AND STATINS IN COMBINATION ASTRAZENECA AB (SE) 2008-08-20 EP disclosed
US-20070149563-A1 New Compounds PHILLIPS EIFION 2007-06-28 US disclosed
US-20040259909-A1 Treatment of fibromyalgia syndrome ASTRAZENECA AB (SE) 2004-12-23 US disclosed
WO-2004019947-A1 ALPHA-7 NICOTINIC RECEPTOR AGONISTS AND STATINS IN COMBINATION ASTRAZENECA AB (SE) 2004-03-11 WO disclosed
EP-1259508-B1 NOVEL BIARYLCARBOXAMIDES ASTRAZENECA AB (SE) 2003-10-15 EP disclosed
US-20030008867-A1 Compounds ASTRAZENECA AB (SE) 2003-01-09 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 (4 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-20060128749-A1 Compounds DRD2, DRD1, GRIN2A CHRNA7 302/4885HTR3A 737/4885HTR3E 601/4885
US-20070149563-A1 New Compounds DRD1, DRD2, GRIN2A CHRNA7 145/4885HTR3A 667/4885HTR3E 569/4885
US-20030008867-A1 Compounds DRD2, DRD1, GRIN2A CHRNA7 209/4885HTR3A 347/4885HTR3E 350/4885
US-20040259909-A1 Treatment of fibromyalgia syndrome CHRNA7, CHRNA5, CHRNA10 CHRNA7 1/4885HTR3A 71/4885HTR3E 251/4885

“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.