SCHEMBL1242470

SCHEMBL1242470

O=C(O)Nc1cccc(C(C(c2cccnc2)c2cccnc2)n2ccccc2=O)n1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 1/20 0.38
KCNA5 P22460 1/20 0.38
KCNQ1 P51787 1/20 0.38
KCND3 Q9UK17 1/20 0.38
MAP3K5 Q99683 1/20 0.34
ITGB3 P05106 9/20 0.34
ITGAV P06756 9/20 0.34
ITGA2B P08514 5/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP2C9 P11712 1/20 0.33
NAMPT P43490 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPHX2 P34913 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL1241452 0.84 KCNE1 (0.37) KCNE1KCNA5KCNQ1KCND3ITGB3
SCHEMBL1242211 0.81 KCNA5 (0.33) KCNE1KCNA5KCNQ1KCND3SMN1; SMN2
SCHEMBL1243091 0.78 KCNA5 (0.40) KCNE1KCNA5KCND3ALDH1A1SMN1; SMN2
SCHEMBL1243310 0.78 KCNA5 (0.40) KCNE1KCNA5KCND3ALDH1A1SMN1; SMN2
SCHEMBL1241967 0.78 KCNA5 (0.40) KCNE1KCNA5KCND3ALDH1A1SMN1; SMN2
SCHEMBL4196212 0.78 CYP3A4 (0.48) KCNA5ALDH1A1CYP2C9SMN1; SMN2
SCHEMBL1242156 0.77 CFTR (0.42) KCNA5SMN1; SMN2
SCHEMBL1242437 0.72 KCNA5 (0.42) KCNE1KCNA5KCNQ1KCND3
SCHEMBL3885685 0.71 KCNA5 (0.51) KCNE1KCNA5KCNQ1KCND3MAP3K5
SCHEMBL1383486 0.70 TSHR (0.51) KCNE1KCNA5KCNQ1KCND3MAP3K5

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 KCNE1 23/4885KCNA5 11/4885KCNQ1 4/4885

“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.