SCHEMBL16685019

SCHEMBL16685019

Cc1c(CCN2CCC(C(=O)O)CC2)ccc2c1COC2=O

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 15/20 0.74
KCNH2 Q12809 8/20 0.74

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
SCHEMBL18043547 0.90 KCNJ1 (0.72) KCNJ1KCNH2
SCHEMBL16686879 0.90 KCNJ1 (0.72) KCNJ1KCNH2
SCHEMBL15953883 0.87 KCNJ1 (0.71) KCNJ1KCNH2
SCHEMBL10234057 0.86 KCNJ1 (1.00) KCNJ1KCNH2
SCHEMBL18043552 0.86 KCNJ1 (0.65) KCNJ1KCNH2
SCHEMBL14790375 0.85 KCNJ1 (0.79) KCNJ1KCNH2
Hydrochloric Acid SCHEMBL15953616 0.84 KCNJ1 (0.77) KCNJ1KCNH2
SCHEMBL299003 0.84 KCNJ1 (0.81) KCNJ1KCNH2
Trifluoroacetic Acid SCHEMBL17360760 0.83 KCNJ1 (0.80) KCNJ1KCNH2
SCHEMBL15758902 0.83 KCNJ1 (0.64) 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 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-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
US-20160257670-A1 Inhibitors of the Renal Outer Medullary Potassium Channel MERCK SHARP & DOHME CORP. (US) 2016-09-08 US disclosed
EP-3063142-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL Merck Sharp & Dohme Corp. (US) 2016-09-07 EP disclosed
WO-2015065866-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2015-05-07 WO 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 22/4885

“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.