SCHEMBL7210902

SCHEMBL7210902

CCCC(C)(C)CCCC[S+]([O-])CCCCC(C)(C)CCCO

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 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
SCHEMBL6507169 0.92 CYP4F2 (0.32) CYP4F2CYP4A11
SCHEMBL6501203 0.90 CYP4F2 (0.35) CYP4F2CYP4A11LMNAALDH1A1HSD17B10
SCHEMBL6510683 0.86 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL6510387 0.84 FFAR1 (0.31)
SCHEMBL1659019 0.84 SMN1; SMN2 (0.48) CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1
SCHEMBL6504494 0.82 FFAR1 (0.34)
SCHEMBL1658863 0.82 LMNA (0.50) CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1
SCHEMBL1658327 0.82 SMN1; SMN2 (0.50) CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1
SCHEMBL6709812 0.80
SCHEMBL6505954 0.80 TBXAS1 (0.40) CYP4F2CYP4A11

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-1366024-A2 SULFOXIDE AND BIS-SULFOXIDE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES Esperion Therapeutics Inc. (US) 2003-12-03 EP disclosed
WO-2002030882-A2 SULFOXIDE AND BIS-SULFOXIDE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2002-04-18 WO disclosed