SCHEMBL30230266

SCHEMBL30230266

C=C(C)C(=O)OCCOC[C@H]1O[C@H](OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ TLR4 O00206 1/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ LGALS8 O00214 1/20 0.39
▸ LGALS3 P17931 1/20 0.39
▸ LGALS4 P56470 1/20 0.39
▸ PTPN1 P18031 1/20 0.38
▸ STAT3 P40763 4/20 0.38
▸ SLC28A3 Q9HAS3 1/20 0.38

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
SCHEMBL29227592 1.00 THRB (0.42) THRBL3MBTL1MAPTTLR4SLC6A2
SCHEMBL22452303 0.89 TLR4 (0.45) L3MBTL1MAPTTLR4PTPN1SLC28A3
SCHEMBL16351461 0.87 TLR4 (0.42) MAPTTLR4LGALS8LGALS3LGALS4
SCHEMBL9733602 0.85 THRB (0.44) THRBL3MBTL1MAPTLGALS8LGALS3
SCHEMBL9187105 0.85 THRB (0.44) THRBL3MBTL1MAPTLGALS8LGALS3
SCHEMBL15963878 0.83 MAOB (0.44) L3MBTL1MAPTLGALS8LGALS3LGALS4
SCHEMBL15961754 0.83 MAOB (0.44) L3MBTL1MAPTLGALS8LGALS3LGALS4
SCHEMBL7870044 0.83 MAOB (0.44) L3MBTL1MAPTLGALS8LGALS3LGALS4
SCHEMBL15961758 0.83 MAOB (0.44) L3MBTL1MAPTLGALS8LGALS3LGALS4
SCHEMBL513822 0.83 MAOB (0.44) L3MBTL1MAPTLGALS8LGALS3LGALS4

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-2023001650-A1 PRE-TREATMENT COMPOSITION FOR INKJET PRINTING AGFA NV (BE) 2023-01-26 — — WO disclosed
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