SCHEMBL5705484

SCHEMBL5705484

CC(C)(C=O)CCCCCCCC(=O)CCCC(C)(C)C(O)O

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
SPTLC1 O15269 1/20 0.30
SPTLC2 O15270 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
SCHEMBL5705318 0.95 ACACB (0.32) ACACBACACAMAPTKMT2ASPTLC1
SCHEMBL5705420 0.95 ACACB (0.32) ACACBACACAMAPTKMT2ASPTLC1
SCHEMBL5705451 0.88 ACACB (0.33) ACACBACACAMAPTKMT2A
SCHEMBL5705564 0.88 ACACB (0.33) ACACBACACAMAPTKMT2A
SCHEMBL3283638 0.86 MAPT (0.39) ACACBACACAMAPTKMT2A
SCHEMBL3286753 0.84 MAPT (0.35) MAPTKMT2A
SCHEMBL5705447 0.81 MAPT (0.35) ACACBACACAMAPTKMT2ASPTLC1
SCHEMBL3278853 0.80 FNTA (0.32) MAPTKMT2A
SCHEMBL5705561 0.79 ACACB (0.32) ACACBACACAMAPTKMT2A
SCHEMBL5705296 0.77 KMT2A (0.38) MAPTKMT2ASPTLC1SPTLC2

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-1326822-A2 KETONE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES Esperion Therapeutics Inc. (US) 2003-07-16 EP claimed
WO-2002030860-A9 KETONE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS INC (US) 2003-02-20 WO claimed
WO-2002030860-A2 KETONE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2002-04-18 WO claimed
EP-1701931-A1 KETONE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES Esperion Therapeutics, Inc. (US) 2006-09-20 EP disclosed
WO-2005068412-A1 KETONE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2005-07-28 WO disclosed
EP-1326822-A2 KETONE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES Esperion Therapeutics Inc. (US) 2003-07-16 EP disclosed
WO-2002030860-A2 KETONE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2002-04-18 WO disclosed