SCHEMBL884503

SCHEMBL884503

Nc1cccc(C(Cc2cccnc2-n2cnc3ccccc32)c2cccnc2)n1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 9/20 0.55
KCNH2 Q12809 4/20 0.55
MKNK2 Q9HBH9 8/20 0.42
MKNK1 Q9BUB5 8/20 0.42
ALDH1A1 P00352 1/20 0.38
CYP17A1 P05093 1/20 0.36

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
SCHEMBL885967 0.89 KCNA5 (0.42) KCNA5KCNH2MKNK2MKNK1ALDH1A1
SCHEMBL885805 0.87 KCNA5 (0.41) KCNA5KCNH2MKNK2MKNK1ALDH1A1
SCHEMBL885991 0.87 KCNA5 (0.49) KCNA5KCNH2MKNK2MKNK1ALDH1A1
SCHEMBL2063142 0.83 KCNA5 (0.47) KCNA5KCNH2MKNK2MKNK1ALDH1A1
SCHEMBL886072 0.81 KCNA5 (0.42) KCNA5KCNH2MKNK2MKNK1
SCHEMBL884668 0.80 KCNA5 (0.42) KCNA5KCNH2MKNK2MKNK1ALDH1A1
SCHEMBL2062839 0.78 MKNK1 (0.43) KCNA5KCNH2MKNK2MKNK1ALDH1A1
SCHEMBL885618 0.77 MET (0.41) KCNA5KCNH2MKNK2MKNK1ALDH1A1
SCHEMBL885633 0.75 KCNA5 (0.47) KCNA5KCNH2MKNK2MKNK1ALDH1A1
SCHEMBL885573 0.75 KCNA5 (0.50) KCNA5KCNH2MKNK2MKNK1ALDH1A1

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 5 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

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 3/4885MKNK2 330/4885

“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.