SCHEMBL884672

SCHEMBL884672

O=C(NCc1cccc(F)c1)c1cccc(-c2ccccc2CC(c2cccnc2)c2cccnc2)c1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 9/20 0.61
KCNH2 Q12809 6/20 0.57
SMN1; SMN2 Q16637 1/20 0.51
ROCK2 O75116 4/20 0.49
PTAFR P25105 1/20 0.49
AURKA O14965 1/20 0.48
DGAT2 Q96PD7 1/20 0.46
NPC1 O15118 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL885046 0.93 KCNA5 (0.67) KCNA5KCNH2SMN1; SMN2ROCK2NPC1
SCHEMBL884585 0.92 KCNA5 (0.66) KCNA5KCNH2SMN1; SMN2HTTKMT2A
SCHEMBL884694 0.89 KCNA5 (0.65) KCNA5KCNH2SMN1; SMN2ROCK2AURKA
SCHEMBL2063939 0.84 KCNA5 (0.63) KCNA5KCNH2SMN1; SMN2ROCK2NPC1
SCHEMBL884297 0.83 KCNA5 (0.67) KCNA5KCNH2SMN1; SMN2PTAFRNPC1
SCHEMBL884739 0.80 KCNA5 (0.78) KCNA5KCNH2
SCHEMBL884689 0.80 KCNA5 (0.68) KCNA5KCNH2ROCK2NPC1
SCHEMBL884480 0.80 KCNA5 (0.71) KCNA5KCNH2
SCHEMBL884700 0.79 KCNA5 (0.67) KCNA5KCNH2SMN1; SMN2ROCK2
SCHEMBL884716 0.79 KCNA5 (0.65) 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 7 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
EP-1940406-A2 POTASSIUM CHANNEL INHIBITORS Merck and Co., Inc. (US) 2008-07-09 EP disclosed
WO-2007050348-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2007-05-03 WO 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 3/4885SMN1; 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.