SCHEMBL1242476

SCHEMBL1242476

OC(c1cccnc1)(c1cccnc1)C(NC1CCCC1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 12/20 0.55
KCNH2 Q12809 7/20 0.55
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39

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
SCHEMBL1240567 0.99 KCNA5 (0.56) KCNA5KCNH2GAAL3MBTL1ALDH1A1
SCHEMBL1241791 0.97 KCNA5 (0.55) KCNA5KCNH2GAAL3MBTL1
SCHEMBL1242035 0.86 KCNA5 (0.43) KCNA5KCNH2
SCHEMBL1240410 0.83 CYP19A1 (0.49) KCNA5KCNH2
SCHEMBL1242207 0.83 KCNA5 (0.51) KCNA5KCNH2
SCHEMBL1242894 0.82 KCNA5 (0.52) KCNA5KCNH2
SCHEMBL1242962 0.80 KCNA5 (0.52) KCNA5KCNH2
SCHEMBL1242260 0.79 KCNA5 (0.50) KCNA5KCNH2
SCHEMBL1242484 0.79 KCNA5 (0.50) KCNA5KCNH2
SCHEMBL1242489 0.79 KCNA5 (0.50) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1781635-B1 POTASSIUM CHANNEL INHIBITORS MERCK SHARP & DOHME (US) 2012-06-13 EP disclosed
US-7879839-B2 For treatment and prevention of cardiac arrhythmias; (+-)-2-Morpholin-4-yl-2-phenyl-1,1-dipyridin-3-yl-ethanol; (+-)-2-[(2-methoxyethyl)(methyl)amino]-2-phenyl-1,1-dipyridin-3-ylethanol MERCK SHARP & DOHME CORP. (US) 2011-02-01 US disclosed
US-20080090794-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME LLC 2008-04-17 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-20080090794-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 KCNA5 11/4885KCNH2 3/4885GAA 3707/4885

“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.