SCHEMBL20804327

SCHEMBL20804327

O=C1C=CC(=O)N1Cc1cc(F)c(I)c(F)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 9/20 0.52
FAAH O00519 4/20 0.52
GSK3A P49840 4/20 0.47
GSK3B P49841 4/20 0.47
PTGS1 P23219 2/20 0.41
PTGS2 P35354 2/20 0.41
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
GMNN O75496 1/20 0.35
THPO P40225 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
HSP90AA1 P07900 1/20 0.34
TLR9 Q9NR96 1/20 0.34
TP53 P04637 1/20 0.34
PKM P14618 1/20 0.34
HPGD P15428 1/20 0.34
XBP1 P17861 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
SCHEMBL17123177 0.81 MGLL (0.52) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL12784728 0.77 MGLL (0.63) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL20804277 0.77 MGLL (0.47) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL15657951 0.69 MGLL (0.78) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL19555152 0.69 MGLL (0.78) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL146412 0.69 MGLL (1.00) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL8734091 0.69 MGLL (0.52) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL32665316 0.69 MGLL (0.57) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL20804233 0.69 MGLL (0.42) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL28411433 0.68 MGLL (0.60) MGLLFAAHGSK3AGSK3BALDH1A1

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
EP-3089962-B1 RADIOIODINATED COMPOUNDS NUTECH VENTURES (US) 2019-03-13 EP disclosed