SCHEMBL31163785

SCHEMBL31163785

O[C@H]1[C@H](O)[C@@H](O)CN(CCCCC(F)COCc2ccc(F)c(F)c2)C[C@@H]1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 17/20 0.43
▸ UGCG Q16739 17/20 0.43
▸ GBA2 Q9HCG7 17/20 0.43
▸ LCT P09848 6/20 0.43
▸ SI P14410 4/20 0.43
▸ MGAM O43451 3/20 0.43
▸ GUSB P08236 2/20 0.35
▸ GAA P10253 1/20 0.34

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
SCHEMBL31163797 0.89 GBA1 (0.38) GBA1UGCGGBA2LCTSI
SCHEMBL31163917 0.87 UGCG (0.49) GBA1UGCGGBA2LCTSI
SCHEMBL31163693 0.87 GBA1 (0.37) GBA1UGCGGBA2LCTSI
SCHEMBL31163691 0.87 GBA1 (0.37) GBA1UGCGGBA2LCTSI
SCHEMBL31163687 0.86 UGCG (0.48) GBA1UGCGGBA2LCTSI
SCHEMBL31163701 0.86 UGCG (0.48) GBA1UGCGGBA2LCTSI
SCHEMBL31163686 0.84 GBA1 (0.48) GBA1UGCGGBA2LCTSI
SCHEMBL31163689 0.84 GUSB (0.43) GBA1UGCGGBA2LCTSI
SCHEMBL31163699 0.84 GUSB (0.43) GBA1UGCGGBA2LCTSI
SCHEMBL31163690 0.84 GBA1 (0.48) GBA1UGCGGBA2LCTSI

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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