SCHEMBL16782353

SCHEMBL16782353

C[C@H]1OC(CO)[C@H](O)C(O)C1N

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LGALS1 P09382 2/20 0.42
▸ LGALS3 P17931 2/20 0.42
▸ LGALS9 O00182 1/20 0.42
▸ LGALS8 O00214 1/20 0.42
▸ CA12 O43570 3/20 0.38
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ CA9 Q16790 3/20 0.38
▸ LMNA P02545 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ PYGB P11216 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ PYGL P06737 2/20 0.36
▸ OGA O60502 2/20 0.36
▸ HEXA P06865 1/20 0.36
▸ HEXB P07686 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ FUCA1 P04066 1/20 0.36

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
SCHEMBL9915195 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL15966422 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL13226135 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL15383279 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL5537919 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL24725036 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL12461641 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL15504331 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL12694347 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12
SCHEMBL31680325 1.00 LGALS1 (0.42) LGALS1LGALS3LGALS9LGALS8CA12

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-9045516-B2 Synthetic ligands for the differentiation of closely related toxins and pathogens UNIVERSITY OF CINCINNATI 2015-06-02 — — US disclosed
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