SCHEMBL885573

SCHEMBL885573

c1cncc(C(Cc2ccccc2-n2cnc3ccccc32)c2cccnc2)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 9/20 0.50
KCNH2 Q12809 3/20 0.50
MKNK2 Q9HBH9 6/20 0.45
MKNK1 Q9BUB5 4/20 0.45
CYP17A1 P05093 1/20 0.44
HTT P42858 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
FGFR1 P11362 1/20 0.41

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
SCHEMBL885991 0.87 KCNA5 (0.49) KCNA5KCNH2MKNK2MKNK1CYP17A1
SCHEMBL885776 0.87 KCNA5 (0.49) KCNA5KCNH2MKNK2MKNK1
SCHEMBL884415 0.87 KCNA5 (0.49) KCNA5KCNH2MKNK2MKNK1
SCHEMBL2062924 0.83 KCNA5 (0.45) KCNA5KCNH2MKNK2MKNK1CYP17A1
SCHEMBL885805 0.79 KCNA5 (0.41) KCNA5KCNH2MKNK2MKNK1CYP17A1
SCHEMBL2062839 0.78 MKNK1 (0.43) KCNA5KCNH2MKNK2MKNK1CYP17A1
SCHEMBL884668 0.77 KCNA5 (0.42) KCNA5KCNH2MKNK2MKNK1CYP17A1
SCHEMBL884428 0.76 KCNA5 (0.47) KCNA5KCNH2
SCHEMBL885618 0.75 MET (0.41) KCNA5KCNH2MKNK2MKNK1CYP17A1
SCHEMBL884503 0.75 KCNA5 (0.55) KCNA5KCNH2MKNK2MKNK1CYP17A1

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.