SCHEMBL7909402

SCHEMBL7909402

CO[C@H]1C[C@H](OCc2ccccc2)[C@H](O)[C@H](C)O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.42
PSEN1 P49768 4/20 0.41
PSEN2 P49810 4/20 0.41
APH1B Q8WW43 4/20 0.41
NCSTN Q92542 4/20 0.41
APH1A Q96BI3 4/20 0.41
PSENEN Q9NZ42 4/20 0.41
MAPT P10636 1/20 0.40
CYP2C19 P33261 1/20 0.40
CYP1A2 P05177 1/20 0.37
SLC6A2 P23975 1/20 0.37
BCHE P06276 1/20 0.35
RECQL P46063 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CTSV O60911 1/20 0.34
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
CTSC P53634 1/20 0.34

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
SCHEMBL8908092 0.85 PDE4D (0.44) PDE4DPSEN1PSEN2APH1BNCSTN
SCHEMBL1776369 0.84 PDE4D (0.51) PDE4DPSEN1PSEN2APH1BNCSTN
SCHEMBL1776370 0.84 PDE4D (0.51) PDE4DPSEN1PSEN2APH1BNCSTN
SCHEMBL10755806 0.84 PDE4D (0.51) PDE4DPSEN1PSEN2APH1BNCSTN
SCHEMBL10755807 0.84 PDE4D (0.51) PDE4DPSEN1PSEN2APH1BNCSTN
SCHEMBL1776371 0.84 PDE4D (0.51) PDE4DPSEN1PSEN2APH1BNCSTN
SCHEMBL19891704 0.82 PDE4D (0.49) PDE4DPSEN1PSEN2APH1BNCSTN
SCHEMBL10807993 0.80 PDE4D (0.54) PDE4DPSEN1PSEN2APH1BNCSTN
SCHEMBL7703090 0.79 PDE4D (0.41) PDE4DMAPTSLC6A2BCHERECQL
SCHEMBL7703088 0.79 PDE4D (0.41) PDE4DMAPTSLC6A2BCHERECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194393-B1 A GLYCOSIDE CONTAINING AN ANOMERIC SULFOXIDE AND NUCLEOPHILIC FUNCTIONAL GROUPS AND HAVING POTENTIAL GLYCOSYL ACCEPTING/DONATING CHARACTERISTICS AND AN ACTIVATING AGENT; RAPID CONSTRUCTION OLIGOSACCHARIDES; GLYCOSYLATION; LIBRARY THE TRUSTEES OF PRINCETON UNIVERSITY 2001-02-27 US disclosed
US-5861492-A LIBRARIES OF SULFOXIDE-SUBSTITUTED GLYCOSIDES WHICH CAN BIND TO OTHER GLYCOSIDES, STEROIDS, AMINO ACIDS, PEPTIDES, LIPIDS OR POLYCYCLIC AROMATIC COMPOUNDS; FOR RAPID, EFFICIENT, SELECTIVE, MULTIPLE GLYCOSYLATION REACTIONS IN ONE STEP THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1999-01-19 US disclosed
US-5792839-A REACTING GLCOSYL DONOR HAVING ANOMERIC SULFOXIDE GROUP AND GLYCOSYL ACCEPTOR AT LOW TEMPERATURE TRUSTEES OF PRINCETON UNIVERSITY (US) 1998-08-11 US disclosed
US-5700916-A INTERMEDIATES FOR FORMING OLIGOSACCHARIDES, INCLUDING 4-HYDROXYTHIOPHENYL-/2-AZIDO-2-DEOXYGLUCO/PYRANOSIDE TRUSTEES OF PRINCETON UNIVERSITY (US) 1997-12-23 US disclosed
US-5639866-A EXPOSING GLYCOSYL ACCEPTOR BOUND TO SOLID SUPPORT TO GLYCOSIDE HAVING ACTIVATED ANOMERIC SULFOXIDE GROUP, FORMING GLYCOSIDIC BOND PRINCETON UNIVERSITY (US) 1997-06-17 US disclosed
US-5635612-A Method of forming multiple glycosidic linkages in a single step THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1997-06-03 US disclosed