SCHEMBL886035

SCHEMBL886035

CS(=O)(=O)Nc1cccc(-c2nc3ccccc3n2-c2ncccc2CC(c2cccnc2)c2cccnc2)n1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 11/20 0.55
KCNH2 Q12809 4/20 0.40
KCNE1 P15382 1/20 0.40
KCNQ1 P51787 1/20 0.40
KCND3 Q9UK17 1/20 0.40
TGFBR1 P36897 5/20 0.38
SLC6A3 Q01959 2/20 0.37
AOC3 Q16853 1/20 0.34
MMP2 P08253 1/20 0.34

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
SCHEMBL885666 0.80 ATR (0.44) KCNA5KCNH2SLC6A3
SCHEMBL885612 0.79 KCNA5 (0.51) KCNA5KCNH2
SCHEMBL10094459 0.79 TGFBR1 (0.39) KCNA5TGFBR1AOC3
SCHEMBL2063142 0.79 KCNA5 (0.47) KCNA5KCNH2KCNE1KCNQ1KCND3
SCHEMBL885958 0.78 KCNA5 (0.52) KCNA5KCNH2AOC3
SCHEMBL885741 0.78 KCNA5 (0.46) KCNA5KCNH2
SCHEMBL885038 0.78 KCNA5 (0.53) KCNA5KCNH2AOC3
SCHEMBL885845 0.77 KCNA5 (0.44) KCNA5KCNH2
SCHEMBL886404 0.75 KCNA5 (0.44) KCNA5KCNH2
SCHEMBL886251 0.75 KCNA5 (0.48) KCNA5KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 US claimed
EP-1940406-A2 POTASSIUM CHANNEL INHIBITORS Merck and Co., Inc. (US) 2008-07-09 EP claimed
WO-2007050348-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2007-05-03 WO claimed
US-8148535-B2 Potassium channel inhibitors MERCK SHARP & DOHME CORP. (US) 2012-04-03 US disclosed
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 US disclosed
EP-1940406-A2 POTASSIUM CHANNEL INHIBITORS Merck and Co., Inc. (US) 2008-07-09 EP disclosed
WO-2007050348-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2007-05-03 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-20090233897-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 KCNA5 11/4885KCNH2 3/4885KCNE1 23/4885

“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.