SCHEMBL884699

SCHEMBL884699

Nc1ccc(-c2ccccc2CC(c2cccnc2)c2cccnc2)cn1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 18/20 0.73
KCNH2 Q12809 9/20 0.71
DYRK1A Q13627 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL884524 0.85 KCNA5 (0.63) KCNA5KCNH2DYRK1ADYRK1B
SCHEMBL2063707 0.85 KCNA5 (1.00) KCNA5KCNH2SMN1; SMN2
SCHEMBL2062779 0.83 KCNA5 (1.00) KCNA5KCNH2
SCHEMBL885074 0.83 KCNA5 (0.81) KCNA5KCNH2SMN1; SMN2
SCHEMBL884659 0.81 KCNA5 (0.68) KCNA5KCNH2
SCHEMBL2063325 0.81 KCNA5 (1.00) KCNA5KCNH2SMN1; SMN2
SCHEMBL884646 0.80 KCNA5 (0.71) KCNA5KCNH2
SCHEMBL884934 0.78 KCNA5 (0.70) KCNA5KCNH2
SCHEMBL884950 0.78 KCNA5 (0.71) KCNA5KCNH2SMN1; SMN2
SCHEMBL885137 0.77 KCNA5 (0.78) KCNA5KCNH2SMN1; SMN2

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 3/4885DYRK1A 2509/4885

“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.