SCHEMBL16684940

SCHEMBL16684940

N#Cc1cc(NC(=O)C2CCN(CCc3ccc4c(c3)COC4=O)CC2)ccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 16/20 0.62
KCNH2 Q12809 15/20 0.62
ALDH1A1 P00352 2/20 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
SCHEMBL16693988 0.90 KCNJ1 (0.62) KCNJ1KCNH2ALDH1A1
SCHEMBL16693993 0.86 KCNJ1 (0.71) KCNJ1KCNH2
SCHEMBL16685110 0.85 KCNJ1 (0.72) KCNJ1KCNH2ALDH1A1
SCHEMBL16685085 0.83 KCNJ1 (0.66) KCNJ1KCNH2
SCHEMBL20686505 0.80 KCNJ1 (0.53) KCNJ1KCNH2ALDH1A1
SCHEMBL18061827 0.79 KCNJ1 (0.61) KCNJ1KCNH2ALDH1A1
SCHEMBL16686952 0.79 KCNJ1 (0.54) KCNJ1KCNH2ALDH1A1
SCHEMBL16693984 0.78 KCNJ1 (0.53) KCNJ1KCNH2ALDH1A1
SCHEMBL16693980 0.78 KCNH2 (0.51) KCNJ1KCNH2ALDH1A1
SCHEMBL10232446 0.77 KCNJ1 (1.00) 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3063142-B1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2019-01-30 EP claimed
US-20160257670-A1 Inhibitors of the Renal Outer Medullary Potassium Channel MERCK SHARP & DOHME CORP. (US) 2016-09-08 US claimed
EP-3063142-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL Merck Sharp & Dohme Corp. (US) 2016-09-07 EP claimed
WO-2015065866-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2015-05-07 WO claimed
EP-3063142-B1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2019-01-30 EP disclosed
EP-3063142-B1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2019-01-30 EP disclosed
US-9951052-B2 Inhibitors of the renal outer medullary potassium channel MERCK SHARP & DOHME CORP. (US) 2018-04-24 US disclosed
US-9951052-B2 Inhibitors of the renal outer medullary potassium channel MERCK SHARP & DOHME CORP. (US) 2018-04-24 US disclosed
US-20160257670-A1 Inhibitors of the Renal Outer Medullary Potassium Channel MERCK SHARP & DOHME CORP. (US) 2016-09-08 US disclosed
US-20160257670-A1 Inhibitors of the Renal Outer Medullary Potassium Channel MERCK SHARP & DOHME CORP. (US) 2016-09-08 US disclosed
WO-2015065866-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2015-05-07 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-20160257670-A1 Inhibitors of the Renal Outer Medullary Potassium Channel KCNJ11, KCNJ1, KCNJ2 KCNJ1 2/4885KCNH2 22/4885ALDH1A1 1722/4885

“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.