SCHEMBL1243523

SCHEMBL1243523

OC(c1cccnc1)(c1cccnc1)C(c1cccc(OC(F)(F)F)c1)N1CCCC1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.65
KCNH2 Q12809 7/20 0.65
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
DYRK1A Q13627 1/20 0.39
NPY5R Q15761 1/20 0.39
SLC6A2 P23975 6/20 0.38
GLS O94925 1/20 0.38

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
SCHEMBL1243082 0.89 KCNA5 (0.72) KCNA5KCNH2CYP11B1CYP11B2
SCHEMBL1242913 0.87 KCNA5 (0.68) KCNA5KCNH2SLC6A2
SCHEMBL1242195 0.86 KCNA5 (0.47) KCNA5KCNH2DYRK1AGLS
SCHEMBL1242771 0.86 KCNA5 (0.69) KCNA5KCNH2SLC6A2
SCHEMBL1242840 0.84 KCNA5 (0.64) KCNA5KCNH2
SCHEMBL1242816 0.83 KCNA5 (0.73) KCNA5KCNH2
SCHEMBL1242073 0.81 KCNA5 (0.73) KCNA5KCNH2
SCHEMBL1243278 0.81 KCNA5 (0.73) KCNA5KCNH2CYP11B1
SCHEMBL1242186 0.81 KCNA5 (0.73) KCNA5KCNH2CYP11B1
SCHEMBL1242084 0.80 KCNA5 (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 3/4885CYP11B1 3290/4885

“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.