SCHEMBL6558771

SCHEMBL6558771

CCS(=O)(=O)N(C)C1CC(C)(C)Oc2cc(Cl)c(F)cc21

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 12/20 0.40
KCNQ1 P51787 12/20 0.40
TRPV1 Q8NER1 4/20 0.34
AKR1B1 P15121 2/20 0.34
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
SCN9A Q15858 1/20 0.31
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30
PSENEN Q9NZ42 1/20 0.30

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
SCHEMBL6559593 0.90 KCNE1 (0.38) KCNE1KCNQ1TRPV1AKR1B1MEN1
SCHEMBL6558662 0.82 KCNE1 (0.39) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6561008 0.81 KCNE1 (0.37) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6559271 0.81 KCNE1 (0.61) KCNE1KCNQ1TRPV1AKR1B1MEN1
SCHEMBL6558686 0.80 DPP4 (0.32) KCNE1KCNQ1TRPV1PSEN1PSEN2
SCHEMBL6559258 0.79 KDM4E (0.37) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6558707 0.77 KCNE1 (0.45) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL8071274 0.77 KCNE1 (0.68) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6561166 0.76 KCNE1 (0.44) KCNE1KCNQ1TRPV1MEN1CYP1A2
SCHEMBL6559329 0.76 KCNE1 (0.44) KCNE1KCNQ1TRPV1MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807629-B1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-03-03 EP claimed
US-6191164-B1 POTASSIUM CHANNEL MODULATORS; ANTIULCER AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2001-02-20 US claimed
EP-0807629-A1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP claimed
EP-1140042-B1 UTILIZATION OF INHIBITORS OF THE KQT1 CHANNEL IN ORDER TO PRODUCE A MEDICAMENT FOR TREATING DISEASES WHICH ARE CAUSED BY PARASITIC HELMINTHS AND ECTOPARASITES SANOFI AVENTIS DEUTSCHLAND (DE) 2008-03-26 EP disclosed
EP-0807629-B1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-03-03 EP disclosed
US-6191164-B1 POTASSIUM CHANNEL MODULATORS; ANTIULCER AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0807629-A1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed