SCHEMBL7206207

SCHEMBL7206207

CCCCCN(C)CCCCCCOC1CCC(CS(=O)(=O)NCC(=O)OCC)CC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 6/20 0.36
EPHX2 P34913 1/20 0.34
KDM4C Q9H3R0 6/20 0.33
PHF8 Q9UPP1 2/20 0.33
DNM1 Q05193 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LTA4H P09960 2/20 0.32
KDM5C P41229 1/20 0.32
KDM5B Q9UGL1 1/20 0.32
LSS P48449 1/20 0.32
KDM4A O75164 2/20 0.31
PLA2G2C Q5R387 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
SCHEMBL4796852 0.88 LSS (0.44) MEN1KMT2ALSS
SCHEMBL7210722 0.86 KMT2A (0.38) KDM5AEPHX2KDM4CPHF8DNM1
SCHEMBL7205007 0.77 KMT2A (0.38) KDM5AEPHX2KDM4CPHF8MEN1
SCHEMBL7210690 0.77 KMT2A (0.38) KDM5AEPHX2KDM4CPHF8MEN1
SCHEMBL7206210 0.75 MEN1 (0.39) KDM5AEPHX2KDM4CPHF8DNM1
SCHEMBL4806617 0.75 LSS (0.42) MEN1KMT2ALSS
SCHEMBL7210730 0.74 EPHX2 (0.39) KDM5AEPHX2KDM4CPHF8DNM1
SCHEMBL7209339 0.74 KDM5A (0.34) KDM5AEPHX2KDM4CPHF8DNM1
SCHEMBL7210727 0.74 EPHX2 (0.39) KDM5AEPHX2KDM4CPHF8DNM1
SCHEMBL7210724 0.73 LTA4H (0.36) KDM5AEPHX2KDM4CPHF8DNM1

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-1311475-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-05-21 EP disclosed
WO-2002014267-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-02-21 WO disclosed