SCHEMBL21090641

SCHEMBL21090641

O[C@H]1CO[C@@H]2COCO[C@H]2[C@@H]1OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.41
▸ PDPK1 O15530 2/20 0.40
▸ MTOR P42345 1/20 0.40
▸ BCHE P06276 5/20 0.39
▸ PDE4D Q08499 1/20 0.34
▸ ACHE P22303 1/20 0.33
▸ HRAS P01112 1/20 0.33
▸ KLK7 P49862 1/20 0.33
▸ KLK5 Q9Y337 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ SLC5A2 P31639 2/20 0.32
▸ TACR1 P25103 1/20 0.32

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
SCHEMBL11981185 0.80 SLC6A2 (0.43) SLC6A2PDPK1MTORBCHEHRAS
SCHEMBL21059413 0.78 SLC6A2 (0.49) SLC6A2PDPK1MTORBCHEPDE4D
SCHEMBL402935 0.78 PDPK1 (0.37) SLC6A2PDPK1MTORBCHEPDE4D
SCHEMBL22400239 0.75 SLC6A2 (0.46) SLC6A2PDPK1MTORBCHEPDE4D
SCHEMBL1561047 0.75 SLC6A2 (0.45) SLC6A2PDPK1MTORBCHEPDE4D
SCHEMBL1561048 0.75 SLC6A2 (0.45) SLC6A2PDPK1MTORBCHEPDE4D
SCHEMBL22349190 0.74 SLC6A2 (0.48) SLC6A2PDPK1MTORBCHEPDE4D
SCHEMBL20458777 0.73 PDPK1 (0.42) SLC6A2PDPK1MTORBCHEPDE4D
SCHEMBL19189020 0.73 SLC6A2 (0.47) SLC6A2BCHEPDE4DACHE
SCHEMBL26900815 0.73 SLC6A2 (0.47) SLC6A2BCHEPDE4DACHE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11582993-B2 Compositions comprising rebaudioside J PEPSICO, INC. (US) 2023-02-21 — — US disclosed
US-20190174806-A1 COMPOSITIONS COMPRISING REBAUDIOSIDE J PEPSICO, INC. (US) 2019-06-13 — — US disclosed
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