SCHEMBL2059641

SCHEMBL2059641

CCCCCCCCCCCC(=O)N[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PYGB P11216 7/20 0.78
GAA P10253 1/20 0.68
EPHX2 P34913 2/20 0.51
PRKCA P17252 1/20 0.48
AKT1 P31749 1/20 0.48
PTK2 Q05397 1/20 0.48
TRPV1 Q8NER1 4/20 0.48
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48
MAPK1 P28482 1/20 0.47

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
SCHEMBL534896 1.00 PYGB (0.78) PYGBGAAEPHX2PRKCAAKT1
SCHEMBL28152781 1.00 PYGB (0.78) PYGBGAAEPHX2PRKCAAKT1
SCHEMBL16696528 1.00 PYGB (0.78) PYGBGAAEPHX2PRKCAAKT1
SCHEMBL13745287 1.00 PYGB (0.78) PYGBGAAEPHX2PRKCAAKT1
SCHEMBL2059625 1.00 PYGB (0.78) PYGBGAAEPHX2PRKCAAKT1
SCHEMBL3792192 1.00 PYGB (0.78) PYGBGAAEPHX2PRKCAAKT1
SCHEMBL13753761 1.00 PYGB (0.78) PYGBGAAEPHX2PRKCAAKT1
SCHEMBL21302832 0.99 PYGB (0.76) PYGBGAAEPHX2TRPV1CNR1
SCHEMBL8669655 0.93 PYGB (0.74) PYGBGAAEPHX2PRKCAAKT1
SCHEMBL8665848 0.93 PYGB (0.74) PYGBGAAEPHX2PRKCAAKT1

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
JP-2012017303-A METHOD FOR PRODUCING AND CONTROLLING OUTER DIAMETER OF HOLLOW FIBER-SHAPED ORGANIC NANOTUBE COMPRISING β-D-GLUCOPYRANOSYLAMINE DERIVATIVE COMPOSITION, AND HOLLOW FIBER-SHAPED ORGANIC NANOTUBE HAVING CONTROLLED OUTER DIAMETER OBTAINED BY THE METHOD NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE & TECHNOLOGY 2012-01-26 JP disclosed