SCHEMBL17925088

SCHEMBL17925088

Cc1c(C(O)CN2CCC3(CCN(c4ccc(C#N)cn4)CC3)C2)ccc2c1COC2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 20/20 1.00
KCNH2 Q12809 4/20 0.91

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
SCHEMBL16438931 1.00 KCNJ1 (1.00) KCNJ1KCNH2
SCHEMBL17925120 0.95 KCNJ1 (1.00) KCNJ1KCNH2
SCHEMBL16438733 0.95 KCNJ1 (1.00) KCNJ1KCNH2
SCHEMBL20184255 0.95 KCNJ1 (1.00) KCNJ1KCNH2
SCHEMBL16438723 0.95 KCNJ1 (1.00) KCNJ1KCNH2
SCHEMBL17925108 0.93 KCNJ1 (1.00) KCNJ1KCNH2
SCHEMBL16438746 0.93 KCNJ1 (1.00) KCNJ1KCNH2
SCHEMBL14919331 0.89 KCNJ1 (0.86) KCNJ1KCNH2
SCHEMBL14919329 0.89 KCNJ1 (0.86) KCNJ1KCNH2
SCHEMBL16438802 0.87 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3027625-B1 SPIRO-FUSED DERIVATIVES OF PIPERIDINE USEFUL FOR THE TREATMENT OF INTER ALIA HYPERTENSION AND ACUTE OR CHRONIC HEART FAILURE MERCK SHARP & DOHME (US) 2018-05-30 EP disclosed
US-9751881-B2 Inhibitors of the renal outer medullary potassium channel MERCK SHARP & DOHME CORP. (US) 2017-09-05 US disclosed
US-20160207922-A1 Inhibitors of the Renal Outer Medullary Potassium Channel MERCK SHARP & DOHME CORP. (US) 2016-07-21 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-20160207922-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.