SCHEMBL16169896

SCHEMBL16169896

Cc1c([C@@H](O)CN2CCCCN(C[C@H](O)c3ccc4c(c3C)COC4=O)CC2)ccc2c1COC2=O

nearest known ligand 0.93

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 19/20 0.93
KCNH2 Q12809 8/20 0.93
ACHE P22303 1/20 0.93
SSTR1 P30872 1/20 0.93
SLC6A4 P31645 1/20 0.93

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
SCHEMBL19413492 0.99 KCNJ1 (0.90) KCNJ1KCNH2ACHESSTR1SLC6A4
SCHEMBL2897116 0.98 KCNJ1 (0.93) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL297123 0.96 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2894677 0.96 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL29778244 0.96 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2894681 0.96 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL297586 0.96 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2897265 0.95 KCNJ1 (0.97) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2898237 0.95 KCNJ1 (0.97) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2899446 0.94 KCNJ1 (0.95) KCNJ1KCNH2ACHESSTR1SLC6A4

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
EP-2773199-B1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2019-04-10 EP disclosed
US-9139585-B2 Inhibitors of the Renal Outer Medullary Potassium channel MERCK SHARP & DOHME CORP. (US) 2015-09-22 US disclosed
US-9139585-B2 Inhibitors of the Renal Outer Medullary Potassium channel MERCK SHARP & DOHME CORP. (US) 2015-09-22 US disclosed
US-20140309213-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME LLC 2014-10-16 US disclosed
US-20140309213-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME LLC 2014-10-16 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-20140309213-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL KCNJ2, KCNJ11, KCNJ1 KCNJ1 3/4885KCNH2 4/4885ACHE 4664/4885

“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.