SCHEMBL31163902

SCHEMBL31163902

O[C@H]1[C@H](O)[C@@H](O)CN(CCC(F)(F)CCCOCc2csc(-c3ccc(F)c(F)c3F)n2)C[C@@H]1O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ UGCG Q16739 18/20 0.36
▸ GBA2 Q9HCG7 18/20 0.36
▸ GBA1 P04062 17/20 0.36
▸ SI P14410 5/20 0.36
▸ LCT P09848 8/20 0.33
▸ MGAM O43451 4/20 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
SCHEMBL31163838 0.88 GBA2 (0.41) UGCGGBA2GBA1SILCT
SCHEMBL31163908 0.87 UGCG (0.39) UGCGGBA2GBA1SILCT
SCHEMBL31163844 0.85 UGCG (0.43) UGCGGBA2GBA1SILCT
SCHEMBL31163911 0.84 UGCG (0.37) UGCGGBA2GBA1SILCT
SCHEMBL31163840 0.83 GBA1 (0.31) UGCGGBA2GBA1SILCT
SCHEMBL31163882 0.79 GBA1 (0.30) UGCGGBA2GBA1SILCT
SCHEMBL31163907 0.77 GBA2 (0.45) UGCGGBA2GBA1SILCT
SCHEMBL31163933 0.77 GBA2 (0.43) UGCGGBA2GBA1SILCT
Hydrochloric Acid SCHEMBL31163880 0.76 GBA2 (0.52) UGCGGBA2GBA1SILCT
SCHEMBL31163888 0.74 GBA2 (0.42) UGCGGBA2GBA1SILCT

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
WO-2024179491-A1 GBA1 AND GCS DUAL MODULATOR ONO PHARMACEUTICAL CO., LTD. (JP) 2024-09-06 — — WO disclosed
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