SCHEMBL14726283

SCHEMBL14726283

Cc1c(C2CN3CCNC[C@H]3CO2)ccc(F)c1C#N

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 20/20 0.51
KCNH2 Q12809 3/20 0.50

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
SCHEMBL14726159 1.00 KCNJ1 (0.51) KCNJ1KCNH2
SCHEMBL14726134 1.00 KCNJ1 (0.51) KCNJ1KCNH2
SCHEMBL14726106 1.00 KCNJ1 (0.51) KCNJ1KCNH2
SCHEMBL14726210 1.00 KCNJ1 (0.51) KCNJ1KCNH2
SCHEMBL14722506 1.00 KCNJ1 (0.51) KCNJ1KCNH2
SCHEMBL15018181 1.00 KCNJ1 (0.51) KCNJ1KCNH2
Hydrochloric Acid SCHEMBL15879078 0.99 KCNJ1 (0.51) KCNJ1KCNH2
Trifluoroacetic Acid SCHEMBL15879082 0.92 KCNJ1 (0.50) KCNJ1KCNH2
Trifluoroacetic Acid SCHEMBL15879432 0.92 KCNJ1 (0.50) KCNJ1KCNH2
Trifluoroacetic Acid SCHEMBL15018058 0.92 KCNJ1 (0.50) KCNJ1KCNH2

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
EP-2956142-B1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2017-09-20 EP disclosed
WO-2013028474-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2013-02-28 WO disclosed