SCHEMBL1243684

SCHEMBL1243684

N#Cc1cccc(C(NC(=O)NCc2ccccc2)C(c2cccnc2)c2cccnc2)c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
VNN1 O95497 3/20 0.44
KCNA5 P22460 2/20 0.44
SGMS2 Q8NHU3 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 1/20 0.42
SLC1A2 P43004 1/20 0.42
MGLL Q99685 1/20 0.42

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
SCHEMBL4580519 0.86 SMN1; SMN2 (0.47) NAMPTSMN1; SMN2LMNAHPGDHTT
SCHEMBL1242307 0.82 KCNA5 (0.48) NAMPTVNN1KCNA5SGMS2MGLL
SCHEMBL1242132 0.82 KCNA5 (0.46) NAMPTSMN1; SMN2LMNAVNN1KCNA5
SCHEMBL1240759 0.78 KCNA5 (0.46) LMNAHPGDKCNA5ALDH1A1
SCHEMBL1376729 0.78 KCNA5 (0.46) NAMPTVNN1KCNA5SGMS2MGLL
SCHEMBL1242332 0.78 CYP19A1 (0.48) HPGDVNN1KCNA5SGMS2ALDH1A1
SCHEMBL1242185 0.78 GRM4 (0.54) HTTVNN1KCNA5SGMS2ALDH1A1
SCHEMBL1240885 0.77 C3AR1 (0.46) LMNAVNN1KCNA5SGMS2ALDH1A1
SCHEMBL1242304 0.76 KCNA5 (0.47) NAMPTVNN1KCNA5SGMS2MGLL
SCHEMBL1240492 0.76 DGAT2 (0.51) NAMPTSMN1; SMN2LMNAHTTVNN1

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 NAMPT 1389/4885SMN1; SMN2 4477/4885LMNA 815/4885

“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.