SCHEMBL27734872

SCHEMBL27734872

CCCCOCC(=O)CC(=O)OCC.[Zr]

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
FAAH O00519 2/20 0.45
CES2 O00748 2/20 0.43
ALDH1A1 P00352 3/20 0.39
PLA2G4B P0C869 3/20 0.38
ATM Q13315 1/20 0.37
MAPT P10636 2/20 0.37
HSD17B10 Q99714 2/20 0.37
EPHX2 P34913 1/20 0.37
TRPA1 O75762 1/20 0.36
TSHR P16473 1/20 0.36
NAAA Q02083 1/20 0.36
DGKA P23743 1/20 0.36

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
SCHEMBL2601700 0.98 MGAM (0.50) GAAMGAMSIMGAM2FAAH
SCHEMBL17144690 0.93 FAAH (0.53) GAAMGAMSIMGAM2FAAH
SCHEMBL11194747 0.89 FAAH (0.56) FAAHCES2ALDH1A1PLA2G4BATM
SCHEMBL7892333 0.87 GAA (0.50) GAAMGAMSIMGAM2FAAH
SCHEMBL129596 0.87 GAA (0.54) GAAMGAMSIMGAM2FAAH
SCHEMBL7892352 0.84 GAA (0.47) GAAMGAMSIMGAM2FAAH
SCHEMBL2601411 0.83 CES2 (0.47) GAAMGAMSIMGAM2FAAH
SCHEMBL546058 0.83 CES2 (0.50) GAAMGAMSIMGAM2CES2
SCHEMBL11385627 0.82 GAA (0.64) GAAMGAMSIMGAM2FAAH
SCHEMBL13709403 0.82 GAA (0.48) 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-101381528-A Gallium phthalocyanine crystal, production process thereof, photoreceptor and image forming apparatus FUJI XEROX CO LTD (JP) 2009-03-11 CN disclosed