SCHEMBL6689588

SCHEMBL6689588

CCCC(O)(CO)C(=O)OO

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
ALOX12 P18054 1/20 0.33
CYP2C19 P33261 1/20 0.33
FDPS P14324 1/20 0.33
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ELANE P08246 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
SCHEMBL8617250 0.86 GAA (0.33) GAACYP4F2CYP4A11ALOX12CYP2C19
SCHEMBL5154964 0.84 FDPS (0.34) GAACYP4F2CYP4A11ALOX12CYP2C19
SCHEMBL739848 0.84 CYP4F2 (0.34) CYP4F2CYP4A11KDM4EPKM
SCHEMBL12952357 0.82 ALDH1A1 (0.38) GAAALOX12CYP2C19FDPSLMNA
SCHEMBL19419871 0.80 PKM (0.46) GAACYP4F2CYP4A11LMNAHSD17B10
SCHEMBL27852258 0.76 FDPS (0.36) GAAALOX12CYP2C19FDPSLMNA
SCHEMBL23754219 0.74 SMPD1 (0.44) FDPSMEN1KMT2A
SCHEMBL16275127 0.74 SMPD1 (0.44) FDPSMEN1KMT2A
SCHEMBL15820331 0.74 CYP4F2 (0.35) GAACYP4F2CYP4A11FDPSMEN1
SCHEMBL29152547 0.70 DGAT1 (0.39) GAAALOX12CYP2C19FDPSLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004084646-A2 COSMETIC COMPOSITIONS COMPRISING PHYTOSTEROL ESTERS ENZYMOTEC LTD. (IL) 2004-10-07 WO disclosed