SCHEMBL7998793

SCHEMBL7998793

COc1ccc2c(c1)NCC2C(=O)C(=O)N(CC(=O)NC1CCC(OC)CC1)CC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MITF O75030 6/20 0.41
OPRK1 P41145 2/20 0.41
HTT P42858 2/20 0.41
PAX8 Q06710 1/20 0.41
KMT2A Q03164 8/20 0.39
MEN1 O00255 7/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C19 P33261 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 6/20 0.39
MAPT P10636 5/20 0.39
PKM P14618 5/20 0.39
NPSR1 Q6W5P4 5/20 0.39
MAPK1 P28482 3/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
KDM4E B2RXH2 2/20 0.39
AGTR1 P30556 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL7947062 0.96 MITF (0.43) MITFOPRK1HTTPAX8KMT2A
SCHEMBL7946743 0.94 MITF (0.45) MITFOPRK1HTTPAX8KMT2A
SCHEMBL7951886 0.94 MITF (0.45) MITFOPRK1HTTPAX8KMT2A
SCHEMBL7993224 0.90 MEN1 (0.42) MITFOPRK1HTTPAX8KMT2A
SCHEMBL7948016 0.87 POLB (0.38) MITFOPRK1HTTPAX8KMT2A
SCHEMBL7947094 0.86 POLB (0.37) MITFOPRK1HTTPAX8KMT2A
SCHEMBL7938360 0.85 POLB (0.36) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL7945107 0.84 POLB (0.36) ALDH1A1MAPTNPC1RAB9AEPHX2
SCHEMBL7947164 0.84 PLA2G2A (0.37) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL7951892 0.84 POLB (0.39) MITFOPRK1HTTPAX8ALDH1A1

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
WO-2009133387-A1 INDOLE- 3 -GLYOXYLAMIDE DERIVATIVES FOR USE AS CALCIUM ION CHANNEL MODULATORS LECTUS THERAPEUTICS LIMITED (GB) 2009-11-05 WO disclosed