SCHEMBL8202220

SCHEMBL8202220

CCNCc1cccc(-c2cccc(CN3CC4(CCCCC4)OC3=O)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.39
GRIN2B Q13224 3/20 0.39
GRM2 Q14416 1/20 0.38
PARP1 P09874 1/20 0.36
HCRTR1 O43613 4/20 0.35
HCRTR2 O43614 4/20 0.35
TACR2 P21452 1/20 0.35
TACR1 P25103 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD11B1 P28845 1/20 0.34
CHRM3 P20309 1/20 0.33
NMT1 P30419 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 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
SCHEMBL8210112 0.84 GRM2 (0.45) GRIN1GRIN2BGRM2PARP1HSD11B1
SCHEMBL3057624 0.83 GRIN1 (0.39) GRIN1GRIN2BGRM2HCRTR1HCRTR2
SCHEMBL3057816 0.81 HCRTR1 (0.44) GRIN1GRIN2BGRM2HCRTR1HCRTR2
SCHEMBL3070124 0.81 TACR2 (0.44) GRIN1GRIN2BGRM2TACR2TACR1
SCHEMBL3057915 0.81 GRIN1 (0.38) GRIN1GRIN2BGRM2HCRTR1HCRTR2
SCHEMBL3076983 0.81 GRIN1 (0.38) GRIN1GRIN2BGRM2TACR2TACR1
SCHEMBL3066926 0.81 CHRM3 (0.42) GRIN1GRIN2BPARP1TACR2TACR1
SCHEMBL3077066 0.81 AOC3 (0.42) GRIN1GRIN2BGRM2HCRTR1HCRTR2
SCHEMBL3067798 0.80 DRD2 (0.43) GRIN1GRIN2BGRM2TACR2TACR1
SCHEMBL3068597 0.80 PSMB8 (0.50) GRIN1GRIN2BGRM2PARP1TACR2

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-2008032191-A2 SPIRO-OXAZOLIDINONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (US) 2008-03-20 WO disclosed