SCHEMBL6605946

SCHEMBL6605946

CCOCCCOc1ccc2c(c1)C(N(C)S(C)(=O)=O)CC(C)(C)O2

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 9/20 0.55
KCNQ1 P51787 9/20 0.55
KCNH2 Q12809 1/20 0.48
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
HRH3 Q9Y5N1 2/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 2/20 0.34
GLA P06280 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PTPN1 P18031 2/20 0.33
PPARD Q03181 1/20 0.33
HPGD P15428 1/20 0.33
CASP1 P29466 1/20 0.33
HSD17B10 Q99714 1/20 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
SCHEMBL6600820 0.89 KCNE1 (0.47) KCNE1KCNQ1KCNH2MEN1KMT2A
SCHEMBL6602375 0.88 KCNE1 (0.49) KCNE1KCNQ1KCNH2MEN1KMT2A
SCHEMBL6602317 0.87 KCNE1 (0.54) KCNE1KCNQ1KCNH2MEN1KMT2A
SCHEMBL6603289 0.86 KCNE1 (0.44) KCNE1KCNQ1KCNH2MEN1KMT2A
SCHEMBL6600854 0.84 KCNE1 (0.46) KCNE1KCNQ1KCNH2MEN1KMT2A
SCHEMBL6601750 0.81 KCNE1 (0.43) KCNE1KCNQ1KCNH2MEN1KMT2A
SCHEMBL6603457 0.81 KCNE1 (0.66) KCNE1KCNQ1KCNH2ALDH1A1
SCHEMBL6601023 0.81 KCNE1 (0.53) KCNE1KCNQ1KCNH2MEN1KMT2A
SCHEMBL6559307 0.79 KCNE1 (0.59) KCNE1KCNQ1KCNH2MEN1KMT2A
SCHEMBL6600267 0.78 KCNE1 (0.48) KCNE1KCNQ1KCNH2MEN1KMT2A

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