SCHEMBL5073383

SCHEMBL5073383

CCCCCCCCCCCCCOC(=O)C(CCC)(C(=O)OCCCCCCCCCCCCC)C(=O)OC1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.36
NAAA Q02083 3/20 0.36
EPHX1 P07099 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 3/20 0.33
EPHX2 P34913 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
RAD52 P43351 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
FAAH O00519 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL9718925 0.87 GAA (0.44) GAAMEN1MAPTKMT2A
SCHEMBL11462556 0.81 GAA (0.46) GAAHTTMEN1MAPTKMT2A
SCHEMBL8949027 0.80 GAA (0.41) GAANAAAEPHX1TSHREPHX2
SCHEMBL7570685 0.80 GAA (0.41) GAANAAAEPHX1TSHREPHX2
SCHEMBL725877 0.79 GAA (0.33) GAANAAAEPHX1TSHREPHX2
SCHEMBL725876 0.79 GAA (0.33) GAANAAAEPHX1TSHREPHX2
SCHEMBL11500771 0.78 GAA (0.41) GAANAAAMEN1MAPTKMT2A
SCHEMBL8948954 0.77 HTR2C (0.48) NAAAEPHX2RAD52NPSR1FAAH
SCHEMBL20438833 0.77 ESR1 (0.44) GAAMAPTALDH1A1
SCHEMBL20429045 0.77 GAA (0.36) GAANAAA

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-1263855-B1 STABILIZER MIXTURES FOR POLYOLEFINS CIBA SC HOLDING AG (CH) 2008-03-12 EP claimed
EP-1077227-B1 Stabilizer mixtures CIBA SC HOLDING AG (CH) 2006-06-07 EP claimed