SCHEMBL286549

SCHEMBL286549

Cc1c(C(O)CN2CCN(C(C)(C)C)CC2)ccc2c1COC2=O

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 19/20 0.84
KCNH2 Q12809 8/20 0.84
ACHE P22303 1/20 0.84
SSTR1 P30872 1/20 0.84
SLC6A4 P31645 1/20 0.84

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
Mk-7145 SCHEMBL2894681 0.92 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL297586 0.92 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL297123 0.92 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL29778244 0.92 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2894677 0.92 KCNJ1 (1.00) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2898237 0.91 KCNJ1 (0.97) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2897265 0.91 KCNJ1 (0.97) KCNJ1KCNH2ACHESSTR1SLC6A4
Mk-7145 SCHEMBL2899446 0.90 KCNJ1 (0.95) KCNJ1KCNH2ACHESSTR1SLC6A4
SCHEMBL2895202 0.89 KCNJ1 (0.88) KCNJ1KCNH2ACHESSTR1SLC6A4
SCHEMBL16169896 0.89 KCNJ1 (0.93) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2632464-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL Merck Sharp & Dohme Corp. (US) 2013-09-04 EP disclosed
WO-2012058134-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2012-05-03 WO disclosed
EP-2427444-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL Merck Sharp & Dohme Corp. (US) 2012-03-14 EP disclosed
WO-2010129379-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2010-11-11 WO disclosed