SCHEMBL6903048

SCHEMBL6903048

O=c1ccn2c(n1)O[C@H](COc1ccc(-c3ccc4c(c3)CCC4)cc1)C2

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 10/20 0.62
SMN1; SMN2 Q16637 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
GPR84 Q9NQS5 2/20 0.35
MEN1 O00255 1/20 0.34

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
SCHEMBL1513447 0.98 GRM2 (0.62) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL3143447 0.92 GRM2 (0.72) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1495903 0.92 GRM2 (0.72) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1495975 0.90 GRM2 (0.72) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1495973 0.90 GRM2 (0.72) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL6905035 0.85 GRM2 (0.63) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1515961 0.85 GRM2 (0.63) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1513660 0.85 GRM2 (0.66) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1513665 0.85 GRM2 (0.66) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1513224 0.84 GRM2 (0.72) GRM2SMN1; SMN2NPSR1KMT2APOLB

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-2011034828-A1 SUBSTITUTED PARA-BIPHENYLOXYMETHYL DIHYDRO OXAZOLOPYRIMIDINONES, PREPARATION AND USE THEREOF SANOFI-AVENTIS (FR) 2011-03-24 WO disclosed