SCHEMBL884594

SCHEMBL884594

Fc1cc(C(F)(F)F)ccc1-c1ncccc1CC(c1cccnc1)c1cccnc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 17/20 0.69
KCNH2 Q12809 8/20 0.55
CYP3A4 P08684 1/20 0.40
CYP3A5 P20815 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL884767 0.82 KCNA5 (0.77) KCNA5KCNH2HRH3
SCHEMBL2062521 0.82 KCNA5 (0.73) KCNA5KCNH2CYP3A4CYP3A5CYP11B1
SCHEMBL884407 0.82 KCNA5 (0.73) KCNA5KCNH2
SCHEMBL884643 0.82 KCNA5 (1.00) KCNA5KCNH2
SCHEMBL884690 0.77 KCNA5 (0.59) KCNA5KCNH2
SCHEMBL885668 0.76 KCNA5 (0.82) KCNA5KCNH2
SCHEMBL885268 0.74 KCNA5 (0.64) KCNA5KCNH2
SCHEMBL884773 0.74 KCNA5 (0.81) KCNA5KCNH2CYP3A4CYP3A5
SCHEMBL884939 0.73 KCNA5 (0.64) KCNA5KCNH2
SCHEMBL884613 0.73 KCNA5 (0.63) KCNA5KCNH2HRH3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 US claimed
EP-1940406-A2 POTASSIUM CHANNEL INHIBITORS Merck and Co., Inc. (US) 2008-07-09 EP claimed
WO-2007050348-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2007-05-03 WO claimed
US-8148535-B2 Potassium channel inhibitors MERCK SHARP & DOHME CORP. (US) 2012-04-03 US disclosed
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 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-20090233897-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 KCNA5 11/4885KCNH2 3/4885CYP3A4 1526/4885

“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.