SCHEMBL17848795

SCHEMBL17848795

CCCCCCCCCCCCOC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GBA1 P04062 2/20 0.44
GJB2 P29033 4/20 0.43
SPHK2 Q9NRA0 1/20 0.42
SPHK1 Q9NYA1 1/20 0.42
MAPK1 P28482 1/20 0.40
TLR4 O00206 1/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
SELP P16109 1/20 0.39
CES2 O00748 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL17848806 1.00 ALDH1A1 (0.46) ALDH1A1TDP1GBA1GJB2SPHK2
SCHEMBL17848813 1.00 ALDH1A1 (0.46) ALDH1A1TDP1GBA1GJB2SPHK2
Biphenyl SCHEMBL29144404 0.88 HK1 (0.42) ALDH1A1TDP1GBA1GJB2SELP
SCHEMBL4594969 0.86 CA2 (0.35) GJB2SPHK2TLR4SELP
SCHEMBL14231358 0.86 CA2 (0.35) GJB2SPHK2TLR4SELP
SCHEMBL4594966 0.86 CA2 (0.35) GJB2SPHK2TLR4SELP
SCHEMBL28111521 0.84 GBA1 (0.56) ALDH1A1TDP1GBA1GJB2SPHK2
SCHEMBL28112005 0.84 GBA1 (0.56) ALDH1A1TDP1GBA1GJB2SPHK2
SCHEMBL9804026 0.84 LGALS8 (0.54) GJB2TLR4
SCHEMBL412539 0.84 LGALS8 (0.54) GJB2TLR4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3389731-B1 ANTIBACTERIAL COMPOSITION CONTAINING A DEOXYHEXOSE ALKYL MONOACETAL OR MONOETHER TEREOS STARCH & SWEETENERS BELGIUM (BE) 2020-07-29 EP disclosed
EP-3389731-A1 ANTIBACTERIAL COMPOSITION CONTAINING A DEOXYHEXOSE ALKYL MONOACETAL OR MONOETHER Tereos Starch & Sweeteners Belgium (BE) 2018-10-24 EP disclosed
EP-3233874-A1 ANTIBACTERIAL COMPOSITION CONTAINING AN ISOMER MIXTURE OF MONOSACCHARIDE ALKYL MONOACETALS OR MONOETHERS Tereos Starch & Sweeteners Belgium (BE) 2017-10-25 EP disclosed
WO-2017103904-A1 ANTIBACTERIAL COMPOSITION CONTAINING A DEOXYHEXOSE ALKYL MONOACETAL OR MONOETHER TEREOS STARCH & SWEETENERS BELGIUM (BE) 2017-06-22 WO disclosed
WO-2016098046-A1 ANTIBACTERIAL COMPOSITION CONTAINING AN ISOMER MIXTURE OF MONOSACCHARIDE ALKYL MONOACETALS OR MONOETHERS SYRAL BELGIUM NV (BE) 2016-06-23 WO disclosed