SCHEMBL7775231

SCHEMBL7775231

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.45
MTOR P42345 1/20 0.45
SSTR1 P30872 1/20 0.44
SSTR2 P30874 1/20 0.44
SSTR4 P31391 1/20 0.44
SSTR3 P32745 1/20 0.44
SSTR5 P35346 1/20 0.44
BCHE P06276 1/20 0.42
FGF1 P05230 2/20 0.41
FGF2 P09038 2/20 0.41
VEGFA P15692 2/20 0.41
HPSE Q9Y251 2/20 0.41
PTPN1 P18031 6/20 0.40
CDC25B P30305 6/20 0.40
PTPN2 P17706 2/20 0.39
PTPN6 P29350 2/20 0.39
PTPN11 Q06124 2/20 0.39
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 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
SCHEMBL25362771 0.90 SSTR1 (0.54) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL7152150 0.90 SSTR1 (0.54) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL26836008 0.90 SSTR1 (0.54) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL18573699 0.90 SSTR1 (0.54) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL20107395 0.90 SSTR1 (0.54) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL14413414 0.90 PDPK1 (0.50) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL24378475 0.90 PDPK1 (0.50) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL18573748 0.90 PDPK1 (0.50) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL24378580 0.90 PDPK1 (0.50) PDPK1MTORSSTR1SSTR2SSTR4
SCHEMBL6878426 0.89 SSTR1 (0.52) PDPK1MTORSSTR1SSTR2SSTR4

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
EP-0837867-B1 MODIFIED ALPHA-D-Glcp-(1-2)-ALPHA-D-Glcp-(1-3)-ALPHA-D-Glcp-ANALOGUES ALBERTA RES COUNCIL (CA) 2001-08-16 EP disclosed
US-5929037-A GLUCOSIDASE I INHIBITORS ALBERTA RESEARCH COUNCIL (CA) 1999-07-27 US disclosed
EP-0837867-A1 MODIFIED $g(a)-D-Glcp-(1-2)-$g(a)-D-Glcp-(1-3)-$g(a)-D-Glcp-ANALOGUES ALBERTA RESEARCH COUNCIL (CA) 1998-04-29 EP disclosed
WO-1996040700-A1 MODIFIED α-D-Glcp-(1-2)-α-D-Glcp-(1-3)-α-D-Glcp-ANALOGUES ALBERTA RESEARCH COUNCIL (CA) 1996-12-19 WO disclosed