SCHEMBL31163765

SCHEMBL31163765

CCCc1ccc(COCC/C=C/CCN2C[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ UGCG Q16739 15/20 0.40
▸ GBA2 Q9HCG7 15/20 0.40
▸ GBA1 P04062 15/20 0.40
▸ LCT P09848 2/20 0.38
▸ SI P14410 2/20 0.38
▸ MGAM O43451 1/20 0.38
▸ GUSB P08236 2/20 0.38
▸ GLB1 P16278 1/20 0.36
▸ SLC5A1 P13866 1/20 0.36
▸ SLC5A2 P31639 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
SCHEMBL31163940 0.83 UGCG (0.55) UGCGGBA2GBA1LCTSI
SCHEMBL31163884 0.83 UGCG (0.54) UGCGGBA2GBA1LCTSI
SCHEMBL31163877 0.74 GUSB (0.44) UGCGGBA2GBA1LCTSI
SCHEMBL31163895 0.73 UGCG (0.56) UGCGGBA2GBA1LCTSI
SCHEMBL31163935 0.71 UGCG (0.48) UGCGGBA2GBA1LCTSI
SCHEMBL31163695 0.70 UGCG (0.68) UGCGGBA2GBA1LCTSI
SCHEMBL31163887 0.68 UGCG (0.72) UGCGGBA2GBA1LCTSI
SCHEMBL31163766 0.68 UGCG (0.55) UGCGGBA2GBA1LCTSI
SCHEMBL31163852 0.68 UGCG (0.68) UGCGGBA2GBA1LCTSI
SCHEMBL31163830 0.66 UGCG (0.73) UGCGGBA2GBA1LCTSI

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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