SCHEMBL6604070

SCHEMBL6604070

CCOC(=O)CCC(C)Oc1ccc2c(c1)C(N(CC)S(C)(=O)=O)CC(C)(C)O2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
GAA P10253 4/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 1/20 0.36
CASP1 P29466 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KCNE1 P15382 6/20 0.35
KCNQ1 P51787 6/20 0.35
SIRT2 Q8IXJ6 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GLA P06280 1/20 0.33
MAPT P10636 2/20 0.31
HTT P42858 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
KCNH2 Q12809 1/20 0.31
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL7913683 0.90 KCNE1 (0.36) ALDH1A1GAAKDM4EHPGDCASP1
SCHEMBL6600820 0.75 KCNE1 (0.47) ALDH1A1GAAKDM4EHPGDCASP1
SCHEMBL6603010 0.72 CNR2 (0.43) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL7479185 0.71 KCNE1 (0.53) ALDH1A1GAAKDM4EHPGDCASP1
SCHEMBL6558694 0.70 HTR1A (0.31) KCNE1KCNQ1
SCHEMBL7913688 0.68 CTSD (0.36) ALDH1A1GAAKDM4EHPGDCASP1
SCHEMBL8479947 0.68 KCNE1 (0.52) ALDH1A1GAAKDM4EHPGDMEN1
SCHEMBL7470000 0.68 KCNE1 (0.56) ALDH1A1KCNE1KCNQ1SMN1; SMN2MAPT
SCHEMBL8482616 0.68 KCNE1 (0.49) ALDH1A1GAAKDM4EHPGDCASP1
SCHEMBL6601925 0.67 KCNE1 (0.44) ALDH1A1GAAKDM4EHPGDCASP1

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