SCHEMBL1243433

SCHEMBL1243433

O=C(N[C@H](c1ccccc1)C(O)(c1cccnc1)c1cccnc1)C(O)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 11/20 0.53
KCNH2 Q12809 6/20 0.45
SMN1; SMN2 Q16637 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
SCHEMBL1243430 1.00 KCNA5 (0.53) KCNA5KCNH2SMN1; SMN2
SCHEMBL1240787 0.84 KCNA5 (0.53) KCNA5KCNH2
SCHEMBL1240785 0.84 KCNA5 (0.53) KCNA5KCNH2
SCHEMBL9902165 0.83 KCNA5 (0.58) KCNA5KCNH2SMN1; SMN2
SCHEMBL9901968 0.83 KCNA5 (0.58) KCNA5KCNH2SMN1; SMN2
SCHEMBL4577826 0.81 KCNA5 (0.53) KCNA5KCNH2
SCHEMBL1242164 0.81 KCNA5 (0.50) KCNA5KCNH2SMN1; SMN2
SCHEMBL1242166 0.81 KCNA5 (0.50) KCNA5KCNH2SMN1; SMN2
SCHEMBL1242249 0.79 KCNA5 (0.48) KCNA5KCNH2SMN1; SMN2
SCHEMBL4186497 0.78 KCNA5 (0.55) 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 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 3/4885SMN1; SMN2 4477/4885

“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.