SCHEMBL9745489

SCHEMBL9745489

COC1(COCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.39
SLC6A2 P23975 2/20 0.38
LGALS8 O00214 1/20 0.38
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
TACR1 P25103 1/20 0.35
OGA O60502 1/20 0.34
GBA1 P04062 2/20 0.34
UGCG Q16739 2/20 0.34
GBA2 Q9HCG7 2/20 0.34
HRAS P01112 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 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
SCHEMBL9745158 1.00 PDE4D (0.39) PDE4DSLC6A2LGALS8TSHRHTT
SCHEMBL10438674 0.88 PDE4D (0.39) PDE4DSLC6A2LGALS8TSHRTACR1
SCHEMBL9745132 0.82 PDE4D (0.40) PDE4DSLC6A2LGALS8TSHRHTT
SCHEMBL9746210 0.82 PDE4D (0.40) PDE4DSLC6A2LGALS8TSHRHTT
SCHEMBL17063222 0.81 CDK1 (0.54) SLC6A2HRASCA2CA9
SCHEMBL10351757 0.80 PDE4D (0.41) PDE4DSLC6A2LGALS8TSHRTACR1
SCHEMBL10351758 0.78 CDK1 (0.40) PDE4DSLC6A2LGALS8TSHRHRAS
SCHEMBL28915008 0.77 TSHR (0.36) PDE4DSLC6A2LGALS8TSHRHRAS
SCHEMBL13339983 0.77 CDK1 (0.40) CA2CA9
SCHEMBL5694018 0.76 LGALS8 (0.39) PDE4DSLC6A2LGALS8TSHROGA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5106967-A Esterified 5-C-hydroxymethyl hexose; bonding to mono- and disaccharides; foods, baked goods, beverages THE PROCTER & GAMBLE COMPANY (US) 1992-04-21 US disclosed
US-5064672-A 5-C-hydroxymethyl hexoses, bulking THE PROCTER & GAMBLE COMPANY (US) 1991-11-12 US disclosed