SCHEMBL7951892

SCHEMBL7951892

COCCNC(=O)CN(CC1CCCCC1)C(=O)C(=O)C1CNc2cc(OC)ccc21

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
HTT P42858 3/20 0.38
MITF O75030 1/20 0.38
OPRK1 P41145 1/20 0.38
PAX8 Q06710 1/20 0.38
ALDH1A1 P00352 4/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
EPHX2 P34913 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
APLNR P35414 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 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
SCHEMBL7945520 0.91 NPC1 (0.39) POLBALDH1A1HPGDEPHX2NPC1
SCHEMBL7979470 0.90 MAPK1 (0.36) ALDH1A1MAPK1NPC1RAB9AAPLNR
SCHEMBL7944071 0.90 HTT (0.40) POLBHTTALDH1A1HPGDEPHX2
SCHEMBL7948016 0.89 POLB (0.38) POLBHTTMITFOPRK1PAX8
SCHEMBL7969063 0.89 CYP2D6 (0.42) POLBMITFPAX8ALDH1A1HPGD
SCHEMBL7982206 0.88 POLB (0.36) POLBHTTMITFOPRK1PAX8
SCHEMBL7946743 0.87 MITF (0.45) POLBHTTMITFOPRK1PAX8
SCHEMBL7951886 0.87 MITF (0.45) POLBHTTMITFOPRK1PAX8
SCHEMBL7947094 0.87 POLB (0.37) POLBHTTMITFOPRK1PAX8
SCHEMBL7947062 0.87 MITF (0.43) POLBHTTMITFOPRK1PAX8

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