SCHEMBL24857442

SCHEMBL24857442

OCC1OC(OCC2OCC(O)C(O)C2O)C(O)C(O)C1O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.55
▸ CDK1 P06493 1/20 0.49
▸ CCNB1 P14635 1/20 0.49
▸ ACHE P22303 1/20 0.46
▸ PTPN1 P18031 2/20 0.43
▸ CA2 P00918 1/20 0.42
▸ LGALS3 P17931 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ CD209 Q9NNX6 1/20 0.42
▸ TYR P14679 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ LGALS8 O00214 1/20 0.41
▸ LGALS4 P56470 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41

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
SCHEMBL18056167 1.00 GAA (0.55) GAACDK1CCNB1ACHEPTPN1
SCHEMBL19860819 0.89 CD209 (0.50) GAACDK1CCNB1PTPN1LGALS3
SCHEMBL14228020 0.89 CD209 (0.50) GAACDK1CCNB1PTPN1LGALS3
SCHEMBL24145155 0.89 GAA (0.42) GAACDK1CCNB1ACHEPTPN1
Melibiose SCHEMBL9799709 0.88 CA2 (0.50) GAACDK1CCNB1ACHEPTPN1
SCHEMBL22054676 0.87 CD209 (0.49) GAACDK1CCNB1ACHEPTPN1
SCHEMBL13647093 0.87 GAA (0.47) GAACDK1CCNB1ACHEPTPN1
SCHEMBL23407842 0.85 LGALS3 (0.53) GAAPTPN1CA2LGALS3CD209
SCHEMBL9078209 0.84 LGALS3 (0.46) GAACDK1CCNB1ACHECA2
SCHEMBL7072121 0.83 GAA (0.58) GAACDK1CCNB1ACHEPTPN1

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
WO-2023278801-A1 SEPARATION OF METAL IONS FROM A SAMPLE USING GLYCOLIPIDS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2023-01-05 — — WO disclosed
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