SCHEMBL29670664

SCHEMBL29670664

O=C(OOP(=O)(O)O)C(O)CO

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.38
PGK2 P07205 1/20 0.38
OR51E2 Q9H255 1/20 0.37
PGD P52209 2/20 0.31
MPI P34949 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
SCHEMBL572817 0.78 OR51E2 (0.50) OR51E2
SCHEMBL5579171 0.77 OR51E2 (0.40) PGK1PGK2OR51E2PGD
SCHEMBL146486 0.76 OR51E2 (0.48) OR51E2
Phosphoric Acid SCHEMBL4267407 0.75 OR51E2 (0.42) PGK1PGK2OR51E2PGD
SCHEMBL1832597 0.75 OR51E2 (0.42) PGK1PGK2OR51E2PGD
SCHEMBL28995134 0.74 OR51E2 (0.46) OR51E2
SCHEMBL17513026 0.73 OR51E2 (0.40) PGK1PGK2OR51E2
SCHEMBL29666492 0.72 PGK1 (0.36) PGK1PGK2OR51E2PGD
SCHEMBL121274 0.70 OR51E2 (0.42) PGK1PGK2OR51E2
SCHEMBL11773175 0.70

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-114544924-A Application of glyceride in disease prediction 中国科学院上海营养与健康研究所 2022-05-27 CN disclosed