SCHEMBL31163807

SCHEMBL31163807

O[C@H]1[C@H](O)[C@@H](O)CN(CCCCCCOCc2ccccc2C2CCCCC2)C[C@@H]1O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GBA2 Q9HCG7 20/20 0.50
▸ GBA1 P04062 17/20 0.50
▸ UGCG Q16739 17/20 0.50
▸ LCT P09848 9/20 0.50
▸ SI P14410 8/20 0.50
▸ MGAM O43451 5/20 0.50

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
SCHEMBL31163836 0.79 UGCG (0.51) GBA2GBA1UGCGLCTSI
SCHEMBL31163859 0.79 UGCG (0.76) GBA2GBA1UGCGLCTSI
SCHEMBL31163928 0.79 UGCG (0.76) GBA2GBA1UGCGLCTSI
SCHEMBL31163934 0.78 UGCG (0.52) GBA2GBA1UGCGLCTSI
SCHEMBL31163781 0.77 GBA2 (0.53) GBA2GBA1UGCGLCTSI
SCHEMBL31163847 0.75 GBA2 (0.60) GBA2GBA1UGCGLCTSI
SCHEMBL31163938 0.74 UGCG (0.73) GBA2GBA1UGCGLCTSI
SCHEMBL31163830 0.74 UGCG (0.73) GBA2GBA1UGCGLCTSI
SCHEMBL21841332 0.71 UGCG (0.70) GBA2GBA1UGCGLCTSI
SCHEMBL31163895 0.71 UGCG (0.56) GBA2GBA1UGCGLCTSI

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