SCHEMBL1513402

SCHEMBL1513402

Cc1cccc(-c2ccc(OCC3Cn4ccc(=O)nc4O3)cc2)c1

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 11/20 0.72
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 2/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL1513398 1.00 GRM2 (0.72) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513606 0.91 GRM2 (0.70) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513610 0.91 GRM2 (0.70) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513911 0.89 GRM2 (0.60) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513488 0.89 GRM2 (0.68) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513486 0.89 GRM2 (0.68) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513912 0.89 GRM2 (0.60) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513227 0.88 GRM2 (0.72) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513224 0.88 GRM2 (0.72) GRM2SMN1; SMN2NPSR1KDM4EMAPT
SCHEMBL1513387 0.88 GRM2 (0.67) GRM2SMN1; SMN2NPSR1KDM4EMAPT

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