SCHEMBL4231702

SCHEMBL4231702

CCC(NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc(OC)cc1)c1ccccc1

nearest known ligand 0.91

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 13/20 0.91
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
TP53 P04637 1/20 0.53
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
KEAP1 Q14145 3/20 0.52
KCNK3 O14649 1/20 0.49
SQSTM1 Q13501 1/20 0.49
NFE2L2 Q16236 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
SCHEMBL4231699 1.00 KCNA5 (0.91) KCNA5ALDH1A1LMNATP53HPGD
SCHEMBL12201016 0.95 KCNA5 (1.00) KCNA5ALDH1A1LMNATP53HPGD
SCHEMBL14267603 0.95 KCNA5 (1.00) KCNA5ALDH1A1LMNATP53HPGD
SCHEMBL14267648 0.95 KCNA5 (1.00) KCNA5ALDH1A1LMNATP53HPGD
SCHEMBL14267594 0.92 KCNA5 (1.00) KCNA5ALDH1A1LMNATP53HPGD
SCHEMBL5072759 0.89 KCNA5 (0.79) KCNA5ALDH1A1LMNATP53HPGD
SCHEMBL14300958 0.89 KCNA5 (0.79) KCNA5ALDH1A1LMNATP53HPGD
SCHEMBL12201448 0.89 KCNA5 (0.75) KCNA5ALDH1A1LMNAHPGDKCNK3
SCHEMBL14267604 0.88 KCNA5 (0.86) KCNA5ALDH1A1LMNATP53HPGD
SCHEMBL12202088 0.87 KCNA5 (0.72) KCNA5ALDH1A1LMNAHPGDKCNK3

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-20090149496-A1 INHIBITORS OF THE TASK-1 AND TASK-3 ION CHANNEL SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-06-11 US claimed
EP-2012758-A2 INHIBITORS OF THE TASK-1 AND TASK-3 ION CHANNEL Sanofi-Aventis Deutschland GmbH (DE) 2009-01-14 EP claimed
WO-2007124849-A2 INHIBITORS OF THE TASK-1 AND TASK-3 ION CHANNEL SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-11-08 WO claimed
US-20090149496-A1 INHIBITORS OF THE TASK-1 AND TASK-3 ION CHANNEL SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-06-11 US disclosed
EP-2012758-A2 INHIBITORS OF THE TASK-1 AND TASK-3 ION CHANNEL Sanofi-Aventis Deutschland GmbH (DE) 2009-01-14 EP disclosed
WO-2007124849-A2 INHIBITORS OF THE TASK-1 AND TASK-3 ION CHANNEL SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-11-08 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 (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-20090149496-A1 INHIBITORS OF THE TASK-1 AND TASK-3 ION CHANNEL KCNN3, CACNA1I, KCNN1 KCNA5 67/4885ALDH1A1 3470/4885LMNA 4157/4885

“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.