SCHEMBL1242894

SCHEMBL1242894

OC(c1cccnc1)(c1cccnc1)C(NCC1CCCCC1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 12/20 0.52
KCNH2 Q12809 7/20 0.52
OPRK1 P41145 1/20 0.43
GBA1 P04062 1/20 0.40
KDM4C Q9H3R0 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
SCHEMBL1242207 0.99 KCNA5 (0.51) KCNA5KCNH2OPRK1GBA1KDM4C
SCHEMBL1242962 0.94 KCNA5 (0.52) KCNA5KCNH2
SCHEMBL1240567 0.83 KCNA5 (0.56) KCNA5KCNH2
SCHEMBL1242476 0.82 KCNA5 (0.55) KCNA5KCNH2
SCHEMBL1241791 0.79 KCNA5 (0.55) KCNA5KCNH2
SCHEMBL1243163 0.79 KCNA5 (0.60) KCNA5KCNH2
SCHEMBL1243322 0.78 KCNA5 (0.59) KCNA5KCNH2
SCHEMBL1240478 0.77 KCNA5 (0.55) KCNA5KCNH2
SCHEMBL1242272 0.75 KCNA5 (0.56) KCNA5KCNH2
SCHEMBL1242484 0.74 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 3/4885OPRK1 1056/4885

“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.