SCHEMBL12434207

SCHEMBL12434207

O=C(NCCc1ccccn1)c1ccccc1-c1ccccc1CNC(=S)Nc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 6/20 0.66
KCNA3 P22001 2/20 0.66
KCNK3 O14649 1/20 0.66
SMN1; SMN2 Q16637 2/20 0.54
MAPT P10636 2/20 0.54
HTT P42858 2/20 0.53
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
ALDH1A1 P00352 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
LMNA P02545 2/20 0.50
RAB9A P51151 1/20 0.50
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL2208589 0.90 KCNA5 (0.68) KCNA5KCNA3KCNK3SMN1; SMN2HTT
SCHEMBL12434219 0.89 KCNA5 (0.72) KCNA5KCNA3KCNK3SMN1; SMN2HTT
SCHEMBL12434216 0.88 MAPT (0.67) KCNA5KCNA3KCNK3SMN1; SMN2MAPT
SCHEMBL2209451 0.84 KCNA5 (0.71) KCNA5KCNA3KCNK3SMN1; SMN2HTT
SCHEMBL12434122 0.82 KCNA5 (0.75) KCNA5KCNA3KCNK3SMN1; SMN2HTT
SCHEMBL12434268 0.82 CNR1 (0.68) KCNA5KCNA3KCNK3SMN1; SMN2MAPT
SCHEMBL12434224 0.82 KCNA5 (0.63) KCNA5KCNA3KCNK3HTTALDH1A1
SCHEMBL12434271 0.80 KCNA5 (0.58) KCNA5KCNA3KCNK3CA1CA2
SCHEMBL12434243 0.80 KCNA5 (0.61) KCNA5KCNA3KCNK3CA1CA2
SCHEMBL2210945 0.80 KCNA5 (0.64) KCNA5KCNA3KCNK3SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
US-7514582-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) 2009-04-07 US disclosed
US-7514582-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) 2009-04-07 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 (1 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-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 90/4885KCNA3 83/4885KCNK3 346/4885

“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.