SCHEMBL7969219

SCHEMBL7969219

CCOC(=O)CN(CC1CCCCC1)C(=O)C(=O)C1CNc2cc(F)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
OXTR P30559 1/20 0.33
AVPR1A P37288 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
PKM P14618 2/20 0.32
ALOX15 P16050 1/20 0.32
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CTSL P07711 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
POLB P06746 1/20 0.31
BLM P54132 1/20 0.31
MGLL Q99685 1/20 0.31
KLK7 P49862 1/20 0.31
CHRM3 P20309 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
HPGD P15428 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
SCHEMBL7982833 0.88 PKM (0.33) KMT2AOXTRAVPR1APKMOPRM1
SCHEMBL7944573 0.87 TDP1 (0.37) L3MBTL1TP53TDP1OPRM1OPRD1
SCHEMBL7980536 0.87 PTGDR2 (0.35) OXTRAVPR1APKMPOLBOPRM1
SCHEMBL7981085 0.83 CA12 (0.34) KMT2AMEN1POLB
SCHEMBL7979149 0.83 NPC1 (0.39) KMT2AMEN1
SCHEMBL7982224 0.83 RAB9A (0.34) KMT2AMEN1PKMALOX15CHRM3
SCHEMBL7981280 0.83 PIN1 (0.40) KMT2AMEN1OXTRAVPR1AL3MBTL1
SCHEMBL7979470 0.82 MAPK1 (0.36)
SCHEMBL7980528 0.80 PKM (0.33) OXTRAVPR1APKM
SCHEMBL7975471 0.80 ALDH1A1 (0.34) OXTRAVPR1APKMTDP1KLK7

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