SCHEMBL6602008

SCHEMBL6602008

CN(C1CC(C)(C)Oc2ccc(O)cc21)S(C)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 16/20 0.44
KCNQ1 P51787 16/20 0.44
MAPT P10636 1/20 0.41
KCNH2 Q12809 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
KCND3 Q9UK17 1/20 0.34
TRPV1 Q8NER1 2/20 0.33

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
SCHEMBL6601004 0.88 KCNE1 (0.46) KCNE1KCNQ1MAPTKCNH2KDM4E
SCHEMBL6560005 0.85 KCNE1 (0.43) KCNE1KCNQ1KCNH2ALDH1A1MEN1
SCHEMBL6602456 0.84 MAPT (0.39) KCNE1KCNQ1MAPTKCNH2KDM4E
SCHEMBL6560808 0.83 KCNE1 (0.41) KCNE1KCNQ1KCNH2TRPV1
SCHEMBL6559947 0.81 KCNE1 (0.51) KCNE1KCNQ1KDM4EMEN1CYP1A2
SCHEMBL6559277 0.81 KCNE1 (0.40) KCNE1KCNQ1MAPTKCNH2KDM4E
SCHEMBL6559596 0.80 KCNE1 (0.36) KCNE1KCNQ1
SCHEMBL6602312 0.79 MAPT (0.35) KCNE1KCNQ1MAPTKCNH2KDM4E
SCHEMBL6604284 0.78 KCNE1 (0.38) KCNE1KCNQ1MAPTKDM4EALDH1A1
SCHEMBL6603457 0.78 KCNE1 (0.66) KCNE1KCNQ1MAPTKCNH2ALDH1A1

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-0906911-B1 Sulfonamid-substituted chromane derivatives (K+channel-blocker), process for their preparation, their use as drugsand pharmaceutical compositions containing them AVENTIS PHARMA GMBH (DE) 2004-04-28 EP disclosed
US-6177449-B1 CARDIOVASCULAR DISORDERS; ANTIULCER AGENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-01-23 US disclosed
EP-0906911-A1 Sulfonamid-substituted chromane derivatives (K+channel-blocker), process for their preparation, their use as drugsand pharmaceutical compositions containing them Hoechst Marion Roussel Deutschland GmbH (DE) 1999-04-07 EP disclosed