SCHEMBL7945107

SCHEMBL7945107

CCN(CC)C(=O)CN(CC1CCCCC1)C(=O)C(=O)C1CNc2cc(OC)ccc21

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC2A1 P11166 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
EPHX2 P34913 1/20 0.33
PTGES O14684 1/20 0.33
TAS2R14 Q9NYV8 1/20 0.33

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
SCHEMBL7938360 0.92 POLB (0.36) POLBALDH1A1MAPTL3MBTL1SLC2A1
SCHEMBL7946077 0.90 POLB (0.35) POLBALDH1A1MAPTL3MBTL1SLC2A1
SCHEMBL7947164 0.89 PLA2G2A (0.37) POLBALDH1A1MAPTL3MBTL1SLC2A1
SCHEMBL7948016 0.87 POLB (0.38) POLBALDH1A1MAPTL3MBTL1NPC1
SCHEMBL7986761 0.87 HTT (0.36) POLBALDH1A1MAPTL3MBTL1
SCHEMBL7969073 0.86 MTNR1B (0.35) POLBALDH1A1PTGDR2
SCHEMBL7946743 0.86 MITF (0.45) POLBALDH1A1MAPTL3MBTL1NPC1
SCHEMBL7951886 0.86 MITF (0.45) POLBALDH1A1MAPTL3MBTL1NPC1
SCHEMBL7947094 0.86 POLB (0.37) POLBALDH1A1MAPTNPC1RAB9A
SCHEMBL7947285 0.86 HPGD (0.36) POLBALDH1A1L3MBTL1PTGDR2

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-2010035032-A1 CALCIUM ION CHANNEL MODULATORS & USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2010-04-01 WO disclosed
WO-2009133387-A1 INDOLE- 3 -GLYOXYLAMIDE DERIVATIVES FOR USE AS CALCIUM ION CHANNEL MODULATORS LECTUS THERAPEUTICS LIMITED (GB) 2009-11-05 WO disclosed