SCHEMBL9051284

SCHEMBL9051284

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

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 2/20 0.47
MTOR P42345 1/20 0.47
SLC6A2 P23975 1/20 0.38
SSTR1 P30872 1/20 0.38
SSTR2 P30874 1/20 0.38
SSTR4 P31391 1/20 0.38
SSTR3 P32745 1/20 0.38
SSTR5 P35346 1/20 0.38
BCHE P06276 2/20 0.37
TNF P01375 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
IDO1 P14902 1/20 0.36
PDE4D Q08499 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
SCHEMBL12302583 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL20107396 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL14490098 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL7163328 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL6544929 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL31065200 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL25365555 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL16319220 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL2456260 1.00 PDPK1 (0.47) PDPK1MTORSLC6A2SSTR1SSTR2
SCHEMBL15847976 0.98 PDPK1 (0.45) PDPK1MTORSLC6A2SSTR1SSTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996005209-A9 SIALIC ACID/FUCOSE BASED MEDICAMENTS 1996-04-11 WO disclosed
EP-0004823-B1 PROCESS FOR THE PREPARATION OF OSIDE DERIVATIVES, DERIVATIVES SO OBTAINED AND THEIR BIOLOGICAL APPLICATIONS ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1983-08-10 EP disclosed
WO-1979000910-A1 PROCESS FOR PREPARING DERIVATIVES OF OSIDES,NEW OSIDE DERIVATIVES OBTAINED AND BIOLOGICAL APPLICATION THEREOF ANVAR (FR) 1979-11-15 WO disclosed
EP-0004823-A2 Process for the preparation of oside derivatives, derivatives so obtained and their biological applications ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1979-10-17 EP disclosed