SCHEMBL727201

SCHEMBL727201

C[C@H](OC(=O)NCc1ccccc1-c1ccccc1OC(=O)NCCc1ccccn1)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 11/20 0.76
KCNA3 P22001 2/20 0.76
TAS1R3 Q7RTX0 2/20 0.52
TAS1R1 Q7RTX1 2/20 0.52
KCNK3 O14649 1/20 0.51
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
NR3C2 P08235 1/20 0.39
MAPK1 P28482 1/20 0.38
FAAH O00519 1/20 0.38
NPY1R P25929 1/20 0.37

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
SCHEMBL5697890 1.00 KCNA5 (0.76) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL5697855 0.91 KCNA5 (0.63) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL5697897 0.91 KCNA5 (0.63) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL5697886 0.91 KCNA5 (0.63) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL2212471 0.86 KCNA5 (1.00) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL498107 0.86 KCNA5 (1.00) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL498106 0.86 KCNA5 (1.00) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL13801062 0.85 KCNA5 (0.82) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL5697901 0.83 KCNA5 (0.56) KCNA5KCNA3TAS1R3TAS1R1KCNK3
SCHEMBL3162863 0.82 KCNA5 (0.75) KCNA5KCNA3TAS1R3TAS1R1KCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4658919-B2 2011-03-23 JP claimed
EP-1720549-A1 KV1.5-BLOCKER FOR THE SELECTIVE INCREASE OF ATRIAL CONTRACTILITY AND TREATMENT OF CARDIAC INSUFFICIENCY Sanofi-Aventis Deutschland GmbH (DE) 2006-11-15 EP claimed
JP-2006520342-A 2006-09-07 JP claimed
EP-1670551-A1 COMBINATION OF PHENYLCARBOXAMIDES WITH BETA-ADRENERGIC RECEPTOR BLOCKERS AND USE THEREOF FOR THE TREATMENT OF ATRIAL ARRHYTHMIAS Sanofi-Aventis Deutschland GmbH (DE) 2006-06-21 EP claimed
EP-1605976-A1 PHENYLCARBOXYL ACID AMIDES AND IK r CHANNEL INHIBITORS COMBINATION AND THE USE THEREOF FOR TREATING ATRIAL ARRHYTHMIA Sanofi-Aventis Deutschland GmbH (DE) 2005-12-21 EP claimed
WO-2005084675-A1 KV1.5-BLOCKER FOR THE SELECTIVE INCREASE OF ATRIAL CONTRACTILITY AND TREATMENT OF CARDIAC INSUFFICIENCY SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-09-15 WO claimed
WO-2005025674-A1 COMBINATION OF PHENYLCARBOXAMIDES WITH BETA-ADRENERGIC RECEPTOR BLOCKERS AND USE THEREOF FOR THE TREATMENT OF ATRIAL ARRHYTHMIAS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-03-24 WO claimed
WO-2004082716-A1 PHENYLCARBOXYL ACID AMIDES AND IKr CHANNEL INHIBITORS COMBINATION AND THE USE THEREOF FOR TREATING ATRIAL ARRHYTHMIA SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-09-30 WO claimed
EP-1605976-B1 PHENYLCARBOXYL ACID AMIDES AND IK r CHANNEL INHIBITORS COMBINATION AND THE USE THEREOF FOR TREATING ATRIAL ARRHYTHMIA SANOFI AVENTIS DEUTSCHLAND (DE) 2010-02-24 EP disclosed
EP-1720549-A1 KV1.5-BLOCKER FOR THE SELECTIVE INCREASE OF ATRIAL CONTRACTILITY AND TREATMENT OF CARDIAC INSUFFICIENCY Sanofi-Aventis Deutschland GmbH (DE) 2006-11-15 EP disclosed
EP-1222163-B1 2'-SUBSTITUTED 1,1'-BIPHENYL-2-CARBONAMIDES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS A MEDICAMENT AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID COMPOUNDS SANOFI AVENTIS DEUTSCHLAND (DE) 2006-07-12 EP disclosed
EP-1670551-A1 COMBINATION OF PHENYLCARBOXAMIDES WITH BETA-ADRENERGIC RECEPTOR BLOCKERS AND USE THEREOF FOR THE TREATMENT OF ATRIAL ARRHYTHMIAS Sanofi-Aventis Deutschland GmbH (DE) 2006-06-21 EP disclosed
EP-1605976-A1 PHENYLCARBOXYL ACID AMIDES AND IK r CHANNEL INHIBITORS COMBINATION AND THE USE THEREOF FOR TREATING ATRIAL ARRHYTHMIA Sanofi-Aventis Deutschland GmbH (DE) 2005-12-21 EP disclosed
WO-2005084675-A1 KV1.5-BLOCKER FOR THE SELECTIVE INCREASE OF ATRIAL CONTRACTILITY AND TREATMENT OF CARDIAC INSUFFICIENCY SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-09-15 WO disclosed
WO-2005025674-A1 COMBINATION OF PHENYLCARBOXAMIDES WITH BETA-ADRENERGIC RECEPTOR BLOCKERS AND USE THEREOF FOR THE TREATMENT OF ATRIAL ARRHYTHMIAS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-03-24 WO disclosed
WO-2004082716-A1 PHENYLCARBOXYL ACID AMIDES AND IKr CHANNEL INHIBITORS COMBINATION AND THE USE THEREOF FOR TREATING ATRIAL ARRHYTHMIA SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-09-30 WO disclosed
EP-1222163-A1 2'-SUBSTITUTED 1,1'-BIPHENYL-2-CARBONAMIDES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS A MEDICAMENT AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID COMPOUNDS Aventis Pharma Deutschland GmbH (DE) 2002-07-17 EP disclosed
WO-2001025189-A1 2'-SUBSTITUTED 1,1'-BIPHENYL-2-CARBONAMIDES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS A MEDICAMENT AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-04-12 WO disclosed