SCHEMBL6602456

SCHEMBL6602456

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

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KCNE1 P15382 14/20 0.35
KCNQ1 P51787 14/20 0.35
TRPV1 Q8NER1 2/20 0.34
KCNH2 Q12809 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
KCND3 Q9UK17 1/20 0.32
MALT1 Q9UDY8 1/20 0.32

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
SCHEMBL6602312 0.85 MAPT (0.35) MAPTKDM4EALDH1A1KCNE1KCNQ1
SCHEMBL6604284 0.85 KCNE1 (0.38) MAPTKDM4EALDH1A1KCNE1KCNQ1
SCHEMBL6602008 0.84 KCNE1 (0.44) MAPTKDM4EALDH1A1KCNE1KCNQ1
SCHEMBL6601004 0.82 KCNE1 (0.46) MAPTKDM4EALDH1A1KCNE1KCNQ1
SCHEMBL6602327 0.82 KCNE1 (0.48) MAPTKDM4EALDH1A1KCNE1KCNQ1
SCHEMBL6602411 0.80 KCNE1 (0.56) MAPTALDH1A1KCNE1KCNQ1
SCHEMBL7910176 0.80 KCNE1 (0.47) MAPTKDM4EALDH1A1KCNE1KCNQ1
SCHEMBL6600267 0.79 KCNE1 (0.48) MAPTKDM4EALDH1A1KCNE1KCNQ1
SCHEMBL7913683 0.79 KCNE1 (0.36) MAPTKDM4EALDH1A1KCNE1KCNQ1
SCHEMBL6600854 0.79 KCNE1 (0.46) MAPTKDM4EALDH1A1KCNE1KCNQ1

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