SCHEMBL29944256

SCHEMBL29944256

CC(O)C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.56
LMNA P02545 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.48
TDP1 Q9NUW8 2/20 0.46
USP2 O75604 1/20 0.42
SLCO1B1 Q9Y6L6 1/20 0.42
KDM4E B2RXH2 2/20 0.40
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
TOP1 P11387 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
SCHEMBL2687657 0.89 PDE4A (0.68) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL5368414 0.87 PDE4A (0.56) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL27494780 0.87 PDE4A (0.56) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL30110431 0.80 PDE4A (0.58) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL28922088 0.80 PDE4A (0.58) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL29257324 0.80 PDE4A (0.46) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL27516225 0.80 PDE4A (0.58) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL321750 0.80 PDE4A (0.58) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL4422883 0.80 PDE4A (0.58) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL92769 0.80 PDE4A (0.58) PDE4ALMNAL3MBTL1TDP1USP2

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-113308447-B Application of arabidopsis UGT74F2 in catalyzing phenyllactic acid to synthesize phenyllactyl glucose 西南大学 2022-09-30 CN disclosed