SCHEMBL10146345

SCHEMBL10146345

Cn1c(=O)n(CC2CC2)c2ccc(-c3cccc(Oc4ccc(N)cc4)c3)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 4/20 0.42
GRM2 Q14416 2/20 0.42
TRIM24 O15164 1/20 0.40
ICMT O60725 2/20 0.40
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MITF O75030 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
GFER P55789 1/20 0.38
NLRP1 Q9C000 1/20 0.38
NOD2 Q9HC29 1/20 0.38
BACE1 P56817 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2B Q13224 2/20 0.37
P2RX3 P56373 1/20 0.36

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
SCHEMBL10146339 0.93 PARG (0.43) PARGGRM2TRIM24ICMTALDH1A1
SCHEMBL625527 0.92 GRM2 (0.51) PARGGRM2TRIM24ICMTSMN1; SMN2
SCHEMBL10145997 0.88 PARG (0.42) PARGGRM2TRIM24ICMTMEN1
SCHEMBL626276 0.87 PARG (0.41) PARGGRM2TRIM24P2RX3
SCHEMBL10146338 0.87 GRIN1 (0.48) PARGGRM2TRIM24ICMTGRIN1
SCHEMBL10146006 0.86 PARG (0.40) PARGGRM2TRIM24ICMTBACE1
SCHEMBL10146348 0.86 GRM2 (0.43) PARGGRM2TRIM24ICMTALDH1A1
SCHEMBL626976 0.84 PARG (0.41) PARGGRM2TRIM24MAPTP2RX3
SCHEMBL10146360 0.83 GRM2 (0.64) PARGGRM2TRIM24ALDH1A1SMN1; SMN2
SCHEMBL624925 0.83 GRM2 (0.46) PARGGRM2TRIM24ICMTSMN1; SMN2

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-2012021382-A1 POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 MERCK SHARP & DOHME CORP. (US) 2012-02-16 WO disclosed