SCHEMBL7989308

SCHEMBL7989308

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

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CNR2 P34972 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
SLC6A9 P48067 1/20 0.32
KCNH2 Q12809 1/20 0.32
KCNQ3 O43525 3/20 0.31
KCNQ2 O43526 3/20 0.31
SIGMAR1 Q99720 4/20 0.31
SCN8A Q9UQD0 1/20 0.31
SCN10A Q9Y5Y9 1/20 0.31
S1PR1 P21453 1/20 0.31
GPR119 Q8TDV5 1/20 0.30
PPARG P37231 1/20 0.30

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
SCHEMBL7971749 0.89 KDM4E (0.35) SLC5A1TDP1L3MBTL1KDM4EALDH1A1
SCHEMBL7947164 0.78 PLA2G2A (0.37) L3MBTL1ALDH1A1POLB
SCHEMBL7982206 0.78 POLB (0.36) ALDH1A1POLB
SCHEMBL7938360 0.77 POLB (0.36) L3MBTL1ALDH1A1POLBSLC6A9
SCHEMBL7945107 0.77 POLB (0.36) L3MBTL1ALDH1A1POLB
SCHEMBL7948016 0.77 POLB (0.38) L3MBTL1KDM4EALDH1A1POLBSLC6A9
SCHEMBL7969219 0.77 KMT2A (0.34) TDP1L3MBTL1POLB
SCHEMBL7946077 0.76 POLB (0.35) L3MBTL1ALDH1A1POLBSLC6A9
SCHEMBL7969073 0.75 MTNR1B (0.35) KDM4EALDH1A1POLB
SCHEMBL7947094 0.75 POLB (0.37) KDM4EALDH1A1POLB

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