SCHEMBL7921748

SCHEMBL7921748

O[C@@H]1[C@@H](O)[C@H](OCc2ccccc2)[C@@H](O)[C@@H](O)[C@H]1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 2/20 0.56
MTOR P42345 1/20 0.56
BCHE P06276 3/20 0.49
TSHR P16473 2/20 0.48
SLC6A2 P23975 2/20 0.46
ALDH1A1 P00352 4/20 0.46
IDO1 P14902 1/20 0.44
ACHE P22303 2/20 0.44
GRM2 Q14416 1/20 0.43
GRM3 Q14832 1/20 0.43
AGXT P21549 1/20 0.43
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
PTGS1 P23219 1/20 0.42
CYP2C19 P33261 1/20 0.42
PTGS2 P35354 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HIF1A Q16665 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
CTSL P07711 1/20 0.42

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
SCHEMBL4350755 1.00 PDPK1 (0.56) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL1978430 0.98 PDPK1 (0.55) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL3315432 0.98 PDPK1 (0.55) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL6577368 0.98 PDPK1 (0.55) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL10678791 0.96 PDPK1 (0.53) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL9439391 0.96 PDPK1 (0.53) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL7209330 0.96 PDPK1 (0.53) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL4865025 0.96 PDPK1 (0.53) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL8194117 0.96 PDPK1 (0.53) PDPK1MTORBCHETSHRSLC6A2
SCHEMBL9455955 0.96 PDPK1 (0.53) PDPK1MTORBCHETSHRSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192949-A1 POLYCARBONATE RESIN, POLYCARBONATE RESIN COMPOSITION, OPTICAL MOLDED ARTICLE COMPRISING SAME, AND CYCLIC CARBONATE ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-06-22 US disclosed
US-20230192949-A1 POLYCARBONATE RESIN, POLYCARBONATE RESIN COMPOSITION, OPTICAL MOLDED ARTICLE COMPRISING SAME, AND CYCLIC CARBONATE ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-06-22 US disclosed
US-6232486-B1 PHOSPHATIDYLINOSITOL PHOSPHATE NUTRIMED BIOTECH 2001-05-15 US disclosed