SCHEMBL19620457

SCHEMBL19620457

CC1OC(CO)C(OCc2ccccc2)C(O)C1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.48
PDE4D Q08499 1/20 0.43
TACR2 P21452 2/20 0.43
LGALS8 O00214 1/20 0.42
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
PDPK1 O15530 1/20 0.40
MTOR P42345 1/20 0.40
GJB2 P29033 1/20 0.39
LGALS3 P17931 1/20 0.38

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
SCHEMBL14413417 1.00 SLC6A2 (0.48) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL19726103 0.90 SLC6A2 (0.47) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL22677749 0.89 LGALS8 (0.44) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL22677496 0.89 LGALS8 (0.44) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL14490090 0.89 SLC6A2 (0.54) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL26836197 0.88 TACR2 (0.47) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL18733216 0.88 TACR2 (0.47) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL9045441 0.88 TACR2 (0.47) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL15280784 0.87 SLC6A2 (0.50) SLC6A2PDE4DTACR2LGALS8TSHR
SCHEMBL12585283 0.87 SLC6A2 (0.50) SLC6A2PDE4DTACR2LGALS8TSHR

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
EP-3246324-A2 PHENYL C-GLUCOSIDE DERIVATIVE CONTAINING DEOXYGLUCOSE STRUCTURE, PREPARATION METHOD AND USES THEREOF Tianjin Institute Of Pharmaceutical Research (CN) 2017-11-22 EP disclosed