SCHEMBL7981155

SCHEMBL7981155

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

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 3/20 0.33
NR1D1 P20393 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
TACR1 P25103 3/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL7981085 0.86 CA12 (0.34)
SCHEMBL7982416 0.85 TACR1 (0.32) TACR1
SCHEMBL7992900 0.71 PTGIR (0.33) SLC6A4
SCHEMBL7981280 0.71 PIN1 (0.40)
SCHEMBL7969219 0.70 KMT2A (0.34) OPRM1
SCHEMBL7982833 0.70 PKM (0.33) OPRM1OPRL1
SCHEMBL22864635 0.69 SLC6A3 (0.38)
SCHEMBL3906901 0.69 PRKAB2 (0.39) HTR2C
SCHEMBL7980536 0.68 PTGDR2 (0.35) OPRM1SLC6A4
SCHEMBL7982224 0.65 RAB9A (0.34) OPRM1

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