SCHEMBL31090366

SCHEMBL31090366

OCC1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c2)C(O)C(O)[C@@H]1O

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD38 P28907 2/20 0.89
DPP4 P27487 1/20 0.89
F2 P00734 1/20 0.79
EPHX2 P34913 3/20 0.48
SLC28A3 Q9HAS3 3/20 0.47
TYR P14679 2/20 0.45
GAA P10253 4/20 0.45
AKR1B1 P15121 3/20 0.45
KDM4E B2RXH2 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 2/20 0.45
P4HB P07237 2/20 0.45
MAPT P10636 2/20 0.45
ADRA2C P18825 1/20 0.45
NOX4 Q9NPH5 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CA12 O43570 1/20 0.45
KDM1A O60341 1/20 0.45

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
SCHEMBL29714132 0.94 CD38 (0.82) CD38DPP4F2EPHX2SLC28A3
SCHEMBL29389947 0.94 CD38 (0.82) CD38DPP4F2EPHX2SLC28A3
SCHEMBL8975217 0.94 CD38 (0.82) CD38DPP4F2EPHX2SLC28A3
SCHEMBL29816458 0.94 CD38 (0.82) CD38DPP4F2EPHX2SLC28A3
Kuromanin SCHEMBL8818180 0.94 CD38 (1.00) CD38DPP4F2EPHX2SLC28A3
Kuromanin SCHEMBL1096430 0.94 CD38 (1.00) CD38DPP4F2EPHX2SLC28A3
Kuromanin SCHEMBL288591 0.94 CD38 (1.00) CD38DPP4F2EPHX2SLC28A3
Kuromanin SCHEMBL1097555 0.94 CD38 (1.00) CD38DPP4F2EPHX2SLC28A3
Kuromanin SCHEMBL409593 0.94 CD38 (1.00) CD38DPP4F2EPHX2SLC28A3
Kuromanin SCHEMBL289710 0.94 CD38 (1.00) CD38DPP4F2EPHX2SLC28A3

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-118667788-A Glycosyltransferase, mutant and application 浙江大学 2024-09-20 CN disclosed