SCHEMBL28048944

SCHEMBL28048944

CCCCC(=O)CC(=O)OCC.[AlH3]

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.56
MGAM O43451 1/20 0.56
SI P14410 1/20 0.56
MGAM2 Q2M2H8 1/20 0.56
FAAH O00519 2/20 0.46
CYP1A2 P05177 1/20 0.45
HAO1 Q9UJM8 1/20 0.42
ALDH1A1 P00352 3/20 0.41
TRPA1 O75762 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
DGKA P23743 1/20 0.41
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 3/20 0.39
POLB P06746 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL17433599 1.00 GAA (0.56) GAAMGAMSIMGAM2FAAH
SCHEMBL1549737 0.98 GAA (0.58) GAAMGAMSIMGAM2FAAH
SCHEMBL7714946 0.94 GAA (0.54) GAAMGAMSIMGAM2FAAH
SCHEMBL2491946 0.92 GAA (0.56) GAAMGAMSIMGAM2FAAH
SCHEMBL6138882 0.90 HAO1 (0.55) GAAMGAMSIMGAM2FAAH
SCHEMBL6138989 0.90 HAO1 (0.55) GAAMGAMSIMGAM2FAAH
SCHEMBL3777425 0.90 HAO1 (0.55) GAAMGAMSIMGAM2FAAH
SCHEMBL472723 0.90 HAO1 (0.55) GAAMGAMSIMGAM2FAAH
SCHEMBL6138705 0.90 HAO1 (0.55) GAAMGAMSIMGAM2FAAH
SCHEMBL3442509 0.90 HAO1 (0.55) GAAMGAMSIMGAM2FAAH

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
CN-105190901-A Field effect transistor TORAY INDUSTRIES 2015-12-23 CN disclosed