SCHEMBL7969135

SCHEMBL7969135

CN(CC1CCCCC1)C(=O)C(=O)C1CNc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.38
SLC6A2 P23975 4/20 0.36
SLC6A4 P31645 4/20 0.36
SLC6A3 Q01959 4/20 0.36
KCNH2 Q12809 3/20 0.36
CYP2D6 P10635 1/20 0.36
AGTR2 P50052 1/20 0.35
DRD4 P21917 1/20 0.34
DRD3 P35462 1/20 0.34
USP30 Q70CQ3 1/20 0.34
ACKR3 P25106 1/20 0.34
F2 P00734 1/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HTR5A P47898 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 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
SCHEMBL7986076 0.83 HDAC1 (0.36) BCHESLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL7948614 0.82 POLB (0.40) NPC1RAB9A
SCHEMBL7946271 0.81 ATM (0.43) KCNH2NPC1RAB9A
SCHEMBL7945088 0.81 HDAC1 (0.38) BCHESLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL7944087 0.80 BCHE (0.37) BCHESLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL7938183 0.80 ALDH1A1 (0.37) KCNH2ACKR3F2PRMT5WDR77
SCHEMBL7944573 0.80 TDP1 (0.37) BCHESLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL13896768 0.79 TACR1 (0.44) NPC1RAB9A
SCHEMBL7945174 0.77 HTR2A (0.40) BCHECYP2D6RAB9A
SCHEMBL7947592 0.76 RAB9A (0.36) BCHESLC6A2SLC6A4SLC6A3KCNH2

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