SCHEMBL14556326

SCHEMBL14556326

CCN(CC)[S+]([O-])c1ccc2c(c1)[C@@H](n1oc3ccc(Cl)cc3c1=O)[C@H](O)C(C)(C)O2

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ABCC9 O60706 19/20 0.71
▸ KCNE1 P15382 1/20 0.38
▸ KCNQ1 P51787 1/20 0.38

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
SCHEMBL481929 0.83 ABCC9 (1.00) ABCC9KCNE1KCNQ1
SCHEMBL13050171 0.78 ABCC9 (1.00) ABCC9KCNE1KCNQ1
SCHEMBL14561911 0.76 ABCC9 (0.70) ABCC9KCNE1KCNQ1
SCHEMBL14561901 0.76 ABCC9 (0.71) ABCC9KCNE1KCNQ1
SCHEMBL482334 0.73 ABCC9 (1.00) ABCC9KCNE1KCNQ1
SCHEMBL481830 0.72 ABCC9 (1.00) ABCC9KCNE1KCNQ1
SCHEMBL13050153 0.71 ABCC9 (0.73) ABCC9KCNE1KCNQ1
SCHEMBL482223 0.71 ABCC9 (1.00) ABCC9
SCHEMBL10268765 0.70 ABCC9 (1.00) ABCC9KCNE1KCNQ1
SCHEMBL482548 0.70 ABCC9 (1.00) ABCC9KCNE1KCNQ1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007027959-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-08 — — WO disclosed
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