SCHEMBL31163877

SCHEMBL31163877

CCCc1ccc(COCC(F)CCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GUSB P08236 2/20 0.44
▸ GLB1 P16278 1/20 0.40
▸ GBA1 P04062 11/20 0.38
▸ UGCG Q16739 10/20 0.38
▸ GBA2 Q9HCG7 10/20 0.38
▸ PYGL P06737 1/20 0.38
▸ GAA P10253 3/20 0.37
▸ LCT P09848 2/20 0.36
▸ SI P14410 2/20 0.36
▸ MGAM O43451 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
SCHEMBL31163925 0.94 GUSB (0.46) GUSBGLB1GBA1UGCGGBA2
SCHEMBL31163689 0.91 GUSB (0.43) GUSBGLB1GBA1UGCGGBA2
SCHEMBL31163699 0.91 GUSB (0.43) GUSBGLB1GBA1UGCGGBA2
SCHEMBL31163686 0.89 GBA1 (0.48) GUSBGBA1UGCGGBA2GAA
SCHEMBL31163690 0.89 GBA1 (0.48) GUSBGBA1UGCGGBA2GAA
SCHEMBL31163917 0.87 UGCG (0.49) GUSBGBA1UGCGGBA2GAA
SCHEMBL31163810 0.87 GUSB (0.38) GUSBGBA1UGCGGBA2LCT
SCHEMBL31163701 0.86 UGCG (0.48) GUSBGBA1UGCGGBA2GAA
SCHEMBL31163687 0.86 UGCG (0.48) GUSBGBA1UGCGGBA2GAA
SCHEMBL31163863 0.86 GBA1 (0.49) GBA1UGCGGBA2PYGLGAA

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
Send feedback