SCHEMBL1242443

SCHEMBL1242443

FC(F)(F)CCNC(c1cc(Cl)cc(Cl)c1)C(c1cccnc1)c1cccnc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 11/20 0.43
KCND3 Q9UK17 1/20 0.43
CYP19A1 P11511 2/20 0.38
SLC6A4 P31645 2/20 0.37
MAPT P10636 3/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
KMT2A Q03164 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KCNH2 Q12809 1/20 0.32
SLC6A2 P23975 1/20 0.32

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
SCHEMBL1242602 0.92 KCNA5 (0.43) KCNA5KCND3CYP19A1SLC6A4MEN1
SCHEMBL1243327 0.88 KCNA5 (0.44) KCNA5KCND3CYP19A1SLC6A4MAPT
SCHEMBL1242824 0.82 POLB (0.42) KCNA5KCND3CYP19A1LMNAKCNH2
SCHEMBL1242782 0.79 KCNA5 (0.45) KCNA5KCND3CYP19A1SLC6A4ALDH1A1
SCHEMBL1242131 0.73 CYP3A4 (0.43) KCNA5KCND3CYP19A1SLC6A4MAPT
SCHEMBL1243417 0.69 POLB (0.44) KCNA5KCND3CYP19A1SLC6A4KCNH2
SCHEMBL1240067 0.68 CYP19A1 (0.53) KCNA5CYP19A1KCNH2
SCHEMBL1242397 0.68 KCNA5 (0.42) KCNA5SLC6A4ALDH1A1LMNAKMT2A
SCHEMBL1243089 0.68 SYK (0.35) KCNA5SLC6A4MAPTLMNASLC6A2
SCHEMBL1242412 0.66 SLC6A2 (0.40) KCNA5KCND3SLC6A4MEN1KMT2A

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 11/4885KCND3 37/4885CYP19A1 4632/4885

“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.