SCHEMBL6730565

SCHEMBL6730565

O[C@H]1[C@H](O)COC(OCc2ccccc2)[C@@H]1O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
TYR P14679 4/20 0.42
TACR1 P25103 1/20 0.41
FUCA1 P04066 2/20 0.41
SLC5A2 P31639 2/20 0.41
BCHE P06276 2/20 0.41
SLC5A1 P13866 1/20 0.41
PDE4D Q08499 1/20 0.39

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
SCHEMBL3425828 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
SCHEMBL3145889 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
SCHEMBL13317630 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
SCHEMBL8600119 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
SCHEMBL3425832 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
SCHEMBL14356311 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
SCHEMBL7143032 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
SCHEMBL3954465 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
SCHEMBL5981862 1.00 SLC6A2 (0.44) SLC6A2CA1CA2CA9TYR
Water SCHEMBL28110031 0.98 SLC6A2 (0.43) SLC6A2CA1CA2CA9TYR

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
US-20040241811-A1 Enzymatic method of producing 4-O-B-D-galactopyranosyl-D-xylose, 4-O-B-D-galactopyranosyl-D-xylose obtained using said method, compositions contain same and the use thereof in evaluating intestinal lactase UNIVERSIDAD AUTONOMA DE MADRID (ES) 2004-12-02 US disclosed