SCHEMBL2566288

SCHEMBL2566288

CNCCCOCc1cccnc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 6/20 0.54
CHRNA4 P43681 6/20 0.54
CHRM2 P08172 3/20 0.47
CHRM1 P11229 2/20 0.47
CHRM3 P20309 2/20 0.47
SCN8A Q9UQD0 1/20 0.47
CYP2D6 P10635 2/20 0.43
CYP1A2 P05177 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTAFR P25105 1/20 0.42
HTR1B P28222 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA7 P36544 1/20 0.41
HRH1 P35367 1/20 0.41
EPHX2 P34913 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
MEN1 O00255 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL7551451 0.90 CHRNB2 (0.57) CHRNB2CHRNA4CHRM2CHRM1CHRM3
SCHEMBL6041506 0.80 HTR1B (0.58) CYP1A2TDP1L3MBTL1HTR1BHRH1
SCHEMBL28856610 0.79 L3MBTL1 (0.60) CHRNB2CHRNA4CHRM2CHRM1CHRM3
SCHEMBL13610217 0.79 L3MBTL1 (0.60) CHRNB2CHRNA4CHRM2CHRM1CHRM3
SCHEMBL7552891 0.79 CYP2A6 (0.61) CHRNB2CHRNA4CHRM2CHRM1CHRM3
SCHEMBL8904555 0.79 CHRM2 (0.48) CHRNB2CHRNA4CHRM2CHRM1CHRM3
SCHEMBL7546154 0.79 CHRNB2 (0.48) CHRNB2CHRNA4CHRM2CHRM1CHRM3
SCHEMBL10263928 0.78 TDP1 (0.53) CHRNB2CHRNA4CHRM2CHRM1CHRM3
SCHEMBL5879455 0.78 L3MBTL1 (0.62) CHRM2CYP2D6CYP1A2TDP1L3MBTL1
SCHEMBL7547915 0.78 CHRNA7 (0.58) CHRNB2CHRNA4CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382274-B1 AQUEOUS COATING COMPOSITION COMPRISING PYRIDINE GROUP-CONTAINING ELECTROCOAT RESIN BASF COATINGS GMBH (DE) 2015-04-22 EP disclosed
EP-2382274-A1 PYRIDINE GROUP-CONTAINING ELECTROCOAT RESIN BASF Coatings GmbH (DE) 2011-11-02 EP disclosed
WO-2010077404-A1 PYRIDINE GROUP-CONTAINING ELECTROCOAT RESIN BASF COATINGS GMBH (US) 2010-07-08 WO disclosed
US-20100167069-A1 PYRIDINE GROUP-CONTAINING ELECTROCOAT RESIN BASF CORPORATION (US) 2010-07-01 US disclosed
US-20100167071-A1 PYRIDINE GROUP-CONTAINING ELECTROCOAT COMPOSITION WITH METAL OXIDE BASF CORPORATION (US) 2010-07-01 US disclosed
EP-1212301-A1 ARYLALKYLOXYALKYLAMINES AND ARYLALKYLTHIOALKYLAMINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS INHIBITORS OF NICOTINIC CHOLINERGIC RECEPTORS Targacept, Inc. (US) 2002-06-12 EP disclosed
EP-1212301-A1 ARYLALKYLOXYALKYLAMINES AND ARYLALKYLTHIOALKYLAMINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS INHIBITORS OF NICOTINIC CHOLINERGIC RECEPTORS Targacept, Inc. (US) 2002-06-12 EP disclosed
WO-2001016107-A1 ARYLALKYLOXYALKYLAMINES AND ARYLALKYLTHIOALKYLAMINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS INHIBITORS OF NICOTINIC CHOLINERGIC RECEPTORS TARGACEPT, INC. (US) 2001-03-08 WO disclosed
WO-2001016107-A1 ARYLALKYLOXYALKYLAMINES AND ARYLALKYLTHIOALKYLAMINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS INHIBITORS OF NICOTINIC CHOLINERGIC RECEPTORS TARGACEPT, INC. (US) 2001-03-08 WO disclosed