SCHEMBL6935461

SCHEMBL6935461

CC1(C)Oc2ccc(OCc3ccccc3)cc2C(NS(C)(=O)=O)C1O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 5/20 0.67
KCNQ1 P51787 5/20 0.67
KCNA5 P22460 9/20 0.49
ABCB1 P08183 3/20 0.46
HIF1A Q16665 2/20 0.44
MAOB P27338 1/20 0.44

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
SCHEMBL6935463 1.00 KCNE1 (0.67) KCNE1KCNQ1KCNA5ABCB1HIF1A
SCHEMBL6932410 0.80 KCNE1 (1.00) KCNE1KCNQ1HIF1A
SCHEMBL6932409 0.80 KCNE1 (1.00) KCNE1KCNQ1HIF1A
SCHEMBL6931989 0.80 KCNE1 (0.68) KCNE1KCNQ1KCNA5ABCB1MAOB
SCHEMBL6603299 0.79 KCNE1 (0.54) KCNE1KCNQ1MAOB
SCHEMBL8479087 0.77 KCNE1 (0.76) KCNE1KCNQ1KCNA5ABCB1HIF1A
SCHEMBL6934369 0.77 KCNE1 (0.61) KCNE1KCNQ1HIF1AMAOB
SCHEMBL6930496 0.76 KCNE1 (0.73) KCNE1KCNQ1KCNA5
SCHEMBL6930493 0.76 KCNE1 (0.73) KCNE1KCNQ1KCNA5
SCHEMBL7477965 0.75 KCNE1 (0.60) KCNE1KCNQ1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0913396-B1 Sulphonamide substituted benzopyran derivatives, process of preparation, their use as medicines and pharmaceutical compositions containing them AVENTIS PHARMA GMBH (DE) 2003-09-17 EP disclosed
EP-0913396-A2 Sulphonamide substituted benzopyran derivatives, process of preparation, their use as medicines and pharmaceutical compositions containing them Hoechst Marion Roussel Deutschland GmbH (DE) 1999-05-06 EP disclosed