SCHEMBL22798303

SCHEMBL22798303

O=C(O)C(CC1CCCCC1)O[C@H]1[C@@H](O)[C@@H](CO)OC(O)[C@@H]1O

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SELE P16581 11/20 0.64
▸ MAPK1 P28482 1/20 0.42
▸ SLC5A1 P13866 1/20 0.36
▸ SLC5A2 P31639 1/20 0.36
▸ SLC2A1 P11166 1/20 0.33

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
SCHEMBL18653472 1.00 SELE (0.64) SELEMAPK1SLC5A1SLC5A2SLC2A1
SCHEMBL8514368 0.82 SELE (0.55) SELE
SCHEMBL8514365 0.82 SELE (0.55) SELE
SCHEMBL8515435 0.82 SELE (0.55) SELE
SCHEMBL14823281 0.82 SELE (0.55) SELE
SCHEMBL17903035 0.79 SELE (1.00) SELE
SCHEMBL12239769 0.76 SELE (0.59) SELE
SCHEMBL13077060 0.76 SELE (0.54) SELEMAPK1
SCHEMBL8515429 0.76 SELE (0.56) SELE
SCHEMBL8515431 0.76 SELE (0.62) SELE

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
EP-3350193-B1 CARBOHYDRATE LIGANDS THAT BIND TO ANTIBODIES AGAINST GLYCOEPITOPES OF GLYCOSPHINGOLIPIDS UNIV BASEL (CH) 2020-12-23 — — EP disclosed
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