SCHEMBL6559540

SCHEMBL6559540

CCN(C1CC(C)(C)Oc2cc(C)c(C)cc21)S(=O)(=O)CC

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 7/20 0.33
KCNQ1 P51787 7/20 0.33
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
KCND3 Q9UK17 1/20 0.32
PKM P14618 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
SCHEMBL6558662 0.86 KCNE1 (0.39) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6559266 0.82 KCNE1 (0.52) KCNE1KCNQ1CYP3A4
SCHEMBL6559417 0.82 KCNE1 (0.37) KCNE1KCNQ1MEN1CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL7830283 0.81 KCNE1 (0.36) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6559337 0.81 KCNE1 (0.47) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6559889 0.80 KCNE1 (0.54) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6561097 0.80 MEN1 (0.38) KCNE1KCNQ1MEN1KMT2A
SCHEMBL6559500 0.80 NPSR1 (0.38) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6559994 0.80 TLR3 (0.41) KCNE1KCNQ1MEN1CYP1A2CYP3A4
SCHEMBL6560823 0.78 SIRT2 (0.35) KCNE1KCNQ1MEN1CYP1A2CYP3A4

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 2 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 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