SCHEMBL5691282

SCHEMBL5691282

C[C@@]1(Sc2ccccc2)O[C@H](CO)[C@@H](OC(=O)CCl)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 2/20 0.37
▸ TACR2 P21452 1/20 0.35
▸ PDPK1 O15530 1/20 0.32
▸ MTOR P42345 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ NT5E P21589 1/20 0.32
▸ CYP2C19 P33261 2/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ TSHR P16473 1/20 0.30
▸ BCHE P06276 1/20 0.30
▸ GSTP1 P09211 2/20 0.30
▸ IDO1 P14902 1/20 0.30
▸ PDE4D Q08499 1/20 0.30

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
SCHEMBL10525908 0.81 LGALS8 (0.37) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL5688958 0.81 SLC6A2 (0.43) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL5691096 0.76 CA12 (0.42) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL9801065 0.74 LGALS8 (0.44) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL9801070 0.74 LGALS8 (0.44) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL9801130 0.73 LGALS8 (0.41) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL10705173 0.73 LGALS8 (0.39) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL28621829 0.72 LGALS8 (0.45) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL9801125 0.72 LGALS8 (0.38) LGALS8TACR2PDPK1MTORSLC6A2
SCHEMBL28208353 0.71 PDPK1 (0.40) TACR2PDPK1MTORSLC6A2NT5E

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-20060166278-A1 Method for synthesizing sugar chain(s) MITSUBISHI CHEMICAL CORPORATION (JP) 2006-07-27 — — US disclosed
EP-1640379-A1 METHOD OF SYNTHESIZING SUGAR CHAIN Mitsubishi Chemical Corporation (JP) 2006-03-29 — — EP disclosed
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