SCHEMBL11097996

SCHEMBL11097996

OC[C@H]1O[C@@H](C(O)[C@H]2OC[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 3/20 0.40
LGALS1 P09382 2/20 0.38
LGALS9 O00182 1/20 0.38
LGALS8 O00214 1/20 0.38
PTPN1 P18031 1/20 0.33
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA9 Q16790 3/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.31
PYGB P11216 1/20 0.31

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
SCHEMBL5793539 0.86 LGALS3 (0.48) LGALS3LGALS1LGALS9LGALS8CA12
SCHEMBL8818669 0.80 LGALS1 (0.44) LGALS3LGALS1LGALS9LGALS8CA12
SCHEMBL12471117 0.80 LGALS1 (0.44) LGALS3LGALS1LGALS9LGALS8CA12
SCHEMBL6932672 0.80 LGALS1 (0.44) LGALS3LGALS1LGALS9LGALS8CA12
SCHEMBL6932667 0.80 LGALS1 (0.44) LGALS3LGALS1LGALS9LGALS8CA12
SCHEMBL28357238 0.80 LGALS1 (0.44) LGALS3LGALS1LGALS9LGALS8CA12
SCHEMBL11215316 0.80 LGALS1 (0.44) LGALS3LGALS1LGALS9LGALS8CA12
SCHEMBL23387517 0.77 PTPN1 (0.40) PTPN1GAA
SCHEMBL28838036 0.77 LGALS3 (0.33) LGALS3LGALS1LGALS9LGALS8CA12
SCHEMBL28376660 0.77 PTPN1 (0.40) PTPN1GAA

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
EP-0100499-A2 Phospholipid derivatives, processes for preparation thereof and pharmaceutical composition of the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-02-15 EP claimed