SCHEMBL498641

SCHEMBL498641

COc1ccc(CC(=O)NCc2ccccc2-c2ccccc2C(=O)NCc2ccc(F)cc2F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 1.00
KCNK3 O14649 2/20 1.00
KCNK5 O95279 1/20 1.00
KCNK17 Q96T54 1/20 1.00
KCNK9 Q9NPC2 1/20 1.00
KCNH2 Q12809 1/20 0.60
NPC1 O15118 2/20 0.50
TAS1R3 Q7RTX0 1/20 0.49
TAS1R1 Q7RTX1 1/20 0.49
POLB P06746 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 3/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL4231221 0.92 KCNA5 (0.85) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL12434336 0.92 KCNA5 (0.84) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL12434391 0.91 KCNA5 (0.83) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL4231667 0.89 KCNA5 (0.79) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL4234451 0.88 KCNA5 (0.79) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL12434396 0.88 KCNA5 (0.79) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL4234905 0.88 KCNA5 (0.78) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL12434045 0.87 KCNA5 (0.78) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL726080 0.87 KCNA5 (0.77) KCNA5KCNK3KCNK5KCNK17KCNK9
SCHEMBL13789620 0.85 KCNA5 (0.74) KCNA5KCNK3KCNK5KCNK17KCNK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200308582-A1 KCNK3-BASED GENE THERAPY OF CARDIAC ARRHYTHMIA Universität Heidelberg (DE) 2020-10-01 US claimed
EP-3694996-A1 KCNK3-BASED GENE THERAPY OF CARDIAC ARRHYTHMIA Universität Heidelberg (DE) 2020-08-19 EP claimed
WO-2019073058-A1 KCNK3-BASED GENE THERAPY OF CARDIAC ARRHYTHMIA Universität Heidelberg (DE) 2019-04-18 WO claimed
US-20070043091-A1 Kv1.5-BLOCKER FOR THE SELECTIVE INCREASE OF ATRIAL CONTRACTILITY AND TREATMENT OF CARDIAC INSUFFICIENCY SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-02-22 US claimed
US-20050054673-A1 Combination of phenylcarboxylic acid amides with beta-adrenoreceptor blockers and their use for the treatment of atrial arrhythmias AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-03-10 US claimed
US-20050038083-A1 Combination of phenylcarboxamides with blockers of the IKr channel and their use for the treatment of atrial arrhythmias AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-02-17 US claimed
US-8106099-B2 2'-{[2-(4-methoxyphenyl)acetylamino]methyl}biphenyl-2-carboxylic acid (2-pyridin-3-ylethyl)amide or other phenylcarboxamide derivatives with dofetilide, ibutilide, almokalant, sotalol, azimilide, amiodarone, E4031, clofilium, ambasilide, MS551, tedisamil, bertosamil and quinidine as IKr chahel blocker SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2012-01-31 US disclosed
US-8106099-B2 2'-{[2-(4-methoxyphenyl)acetylamino]methyl}biphenyl-2-carboxylic acid (2-pyridin-3-ylethyl)amide or other phenylcarboxamide derivatives with dofetilide, ibutilide, almokalant, sotalol, azimilide, amiodarone, E4031, clofilium, ambasilide, MS551, tedisamil, bertosamil and quinidine as IKr chahel blocker SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2012-01-31 US disclosed
US-8106099-B2 2'-{[2-(4-methoxyphenyl)acetylamino]methyl}biphenyl-2-carboxylic acid (2-pyridin-3-ylethyl)amide or other phenylcarboxamide derivatives with dofetilide, ibutilide, almokalant, sotalol, azimilide, amiodarone, E4031, clofilium, ambasilide, MS551, tedisamil, bertosamil and quinidine as IKr chahel blocker SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2012-01-31 US disclosed
US-7982045-B2 2′-substituted 1,1′-biphenyl-2-carboxamides, processes for their preparation, their use as medicaments, and pharmaceutical preparations comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-07-19 US disclosed
US-7982045-B2 2′-substituted 1,1′-biphenyl-2-carboxamides, processes for their preparation, their use as medicaments, and pharmaceutical preparations comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-07-19 US disclosed
US-7982045-B2 2′-substituted 1,1′-biphenyl-2-carboxamides, processes for their preparation, their use as medicaments, and pharmaceutical preparations comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-07-19 US disclosed
US-20090192096-A1 2'-Substituted 1,1'-Biphenyl-2-Carboxamides, Processes For Their Preparation, Their Use As Medicaments, And Pharmaceutical Preparations Comprising Them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-07-30 US 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
US-20050054673-A1 Combination of phenylcarboxylic acid amides with beta-adrenoreceptor blockers and their use for the treatment of atrial arrhythmias AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-03-10 US disclosed
US-20050038083-A1 Combination of phenylcarboxamides with blockers of the IKr channel and their use for the treatment of atrial arrhythmias AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-02-17 US disclosed
US-20040102513-A1 2'-Substituted 1,1'-biphenyl-2-carboxamides, processes for their preparation, their use as medicaments, and pharmaceutical preparations comprising them AVENTIS PHARMA DEUTSCHLAND GMBH 2004-05-27 US disclosed
US-6686395-B2 THERAPY OF A CARDIAC ARRYTHMIA WHICH CAN BE ELIMINATED BY ACTION POTENTIAL PROLONGATION; POTASSIUM CHANNEL MODULATOR AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-02-03 US disclosed
US-20030171351-A1 2'-substituted 1,1'-biphenyl-2-carboxamides, process for their preparation, their use as medicaments, and pharmaceutical preparations comprising them AVENTIS PHARMA DEUTSCHLAND GMBH 2003-09-11 US disclosed
US-6531495-B1 Potassium channel AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-03-11 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 (6 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-20050038083-A1 Combination of phenylcarboxamides with blockers of the IKr channel and their use for the treatment of atrial arrhythmias KCNH2, KCNJ2, KCNH1 KCNA5 6/4885KCNK3 33/4885KCNK5 14/4885
US-20030171351-A1 2'-substituted 1,1'-biphenyl-2-carboxamides, process for their preparation, their use as medicaments, and pharmaceutical preparations comprising them MLLT3, RYR2, KCNH1 KCNA5 104/4885KCNK3 396/4885KCNK5 511/4885
US-20050054673-A1 Combination of phenylcarboxylic acid amides with beta-adrenoreceptor blockers and their use for the treatment of atrial arrhythmias SCN5A, KCNH1, KCNA5 KCNA5 3/4885KCNK3 84/4885KCNK5 16/4885
US-20090192096-A1 2'-Substituted 1,1'-Biphenyl-2-Carboxamides, Processes For Their Preparation, Their Use As Medicaments, And Pharmaceutical Preparations Comprising Them MLLT3, RYR2, CACNA1E KCNA5 90/4885KCNK3 346/4885KCNK5 472/4885
US-20070043091-A1 Kv1.5-BLOCKER FOR THE SELECTIVE INCREASE OF ATRIAL CONTRACTILITY AND TREATMENT OF CARDIAC INSUFFICIENCY KCNJ2, KCNH2, KCNK5 KCNA5 4/4885KCNK3 31/4885KCNK5 3/4885
US-20040102513-A1 2'-Substituted 1,1'-biphenyl-2-carboxamides, processes for their preparation, their use as medicaments, and pharmaceutical preparations comprising them MLLT3, RYR2, CACNA1E KCNA5 97/4885KCNK3 383/4885KCNK5 500/4885

“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.