SCHEMBL4978013

SCHEMBL4978013

C=C[CH]NN1C(=O)C=CC1=O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
MGLL Q99685 1/20 0.31

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
SCHEMBL22015479 0.72 MGLL (0.35) GAAGSK3AGSK3BMGLL
SCHEMBL18282001 0.66
SCHEMBL175725 0.64 MGLL (0.42) GAAGSK3AGSK3BMGLL
SCHEMBL1164273 0.62 MGLL (0.33) MGLL
SCHEMBL2359893 0.62 MGLL (0.35) GSK3AGSK3BMGLL
SCHEMBL2571475 0.60
SCHEMBL1664700 0.60
SCHEMBL2922210 0.60
SCHEMBL28084692 0.60 ALDH1A1 (0.42) GAA
SCHEMBL25936350 0.59 GSK3A (0.32) GSK3AGSK3BMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008120098-A2 PEPTIDE PRODRUGS DIATOS (FR) 2008-10-09 WO claimed
WO-2008120098-A2 PEPTIDE PRODRUGS DIATOS (FR) 2008-10-09 WO disclosed