SCHEMBL375041

SCHEMBL375041

O=C(NC1C2CCN(CC2)C1Cc1cccnc1)c1cccc2ccccc12

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 15/20 0.78
CHRNA4 P43681 15/20 0.78
CHRNA7 P36544 14/20 0.77
HTR3A P46098 1/20 0.69
KCNH2 Q12809 1/20 0.68

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
SCHEMBL372874 0.86 CHRNB2 (1.00) CHRNB2CHRNA4CHRNA7
SCHEMBL372931 0.86 CHRNB2 (1.00) CHRNB2CHRNA4CHRNA7
SCHEMBL373249 0.86 CHRNB2 (0.79) CHRNB2CHRNA4CHRNA7
SCHEMBL373382 0.86 CHRNB2 (0.79) CHRNB2CHRNA4CHRNA7
SCHEMBL373068 0.85 CHRNA7 (0.74) CHRNB2CHRNA4CHRNA7
SCHEMBL15882741 0.85 CHRNB2 (0.85) CHRNB2CHRNA4CHRNA7
SCHEMBL372320 0.85 CHRNA7 (0.76) CHRNB2CHRNA4CHRNA7
SCHEMBL372978 0.84 CHRNB2 (0.70) CHRNB2CHRNA4CHRNA7KCNH2
SCHEMBL372998 0.84 CHRNB2 (0.69) CHRNB2CHRNA4CHRNA7
SCHEMBL373537 0.84 CHRNB2 (0.70) CHRNB2CHRNA4CHRNA7HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2633868-A1 COMBINATION OF ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS Targacept, Inc. (US) 2013-09-04 EP claimed
US-20110059947-A1 ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS TARGACEPT, INC. (US) 2011-03-10 US claimed
EP-2254598-A2 ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS Targacept Inc. (US) 2010-12-01 EP claimed
WO-2009102962-A2 COMBINATION OF ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS TARGACEPT, INC. (US) 2009-08-20 WO claimed
US-20140234270-A1 TREATMENT WTH ALPHAT SELECTIVE LIGANDS TARGACEPT, INC. (US) 2014-08-21 US disclosed
EP-2633868-A1 COMBINATION OF ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS Targacept, Inc. (US) 2013-09-04 EP disclosed
EP-2484363-A1 (2S,3R)-N-(2-((3-pyridinyl)methyl)-1-azabicyclo[2.2.2]oct-3-yl)-5-methylthiophene-2-carboxamide Targacept, Inc. (US) 2012-08-08 EP disclosed
EP-2409703-A1 Treatment with alpha7-selective ligands Targacept, Inc. (US) 2012-01-25 EP disclosed
US-20110262407-A1 TREATMENT WITH ALPHA7 SELECTIVE LIGANDS TARGACEPT, INC. (US) 2011-10-27 US disclosed
EP-2364150-A1 TREATMENT WITH ALPHA 7-SELECTIVE LIGANDS Targacept Inc. (US) 2011-09-14 EP disclosed
US-20110124678-A1 TREATMENT WITH ALPHA 7-SELECTIVE LIGANDS TARGACEPT, INC. (US) 2011-05-26 US disclosed
US-20110059947-A1 ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS TARGACEPT, INC. (US) 2011-03-10 US disclosed
EP-2254598-A2 ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS Targacept Inc. (US) 2010-12-01 EP disclosed
WO-2010056622-A1 TREATMENT WITH ALPHA α7-SELECTIVE LIGANDS TARGACEPT, INC. (US) 2010-05-20 WO disclosed
EP-2185152-A2 ALPHA7 NACHR AGONISTS FOR TREATING OR PREVENTING METABOLIC DISORDERS Targacept Inc. (US) 2010-05-19 EP disclosed
WO-2009102962-A2 COMBINATION OF ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS TARGACEPT, INC. (US) 2009-08-20 WO disclosed
WO-2009018511-A2 ALPHA7 NACHR AGONISTS FOR TREATING OR PREVENTING METABOLIC DISORDERS TARGACEPT, INC. (US) 2009-02-05 WO 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-20110059947-A1 ALPHA 7 NICOTINIC AGONISTS AND ANTIPSYCHOTICS CHRNA7, CHRNA5, CHRNA4 CHRNB2 14/4885CHRNA4 3/4885CHRNA7 1/4885
US-20140234270-A1 TREATMENT WTH ALPHAT SELECTIVE LIGANDS CHRNA7, CHRNA2, CHRNA4 CHRNB2 6/4885CHRNA4 3/4885CHRNA7 1/4885
US-20110124678-A1 TREATMENT WITH ALPHA 7-SELECTIVE LIGANDS CHRNA7, CHRNA1, CHRNG CHRNB2 17/4885CHRNA4 9/4885CHRNA7 1/4885
US-20110262407-A1 TREATMENT WITH ALPHA7 SELECTIVE LIGANDS CHRNA7, CHRNA4, CHRNA2 CHRNB2 6/4885CHRNA4 2/4885CHRNA7 1/4885

“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.