SCHEMBL2926372

SCHEMBL2926372

N#Cc1sccc1-c1ccc(-n2ccccc2=O)cc1-c1ccccn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.36
GRIA3 P42263 1/20 0.36
PDE4D Q08499 1/20 0.36
GLA P06280 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HCRTR1 O43613 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GRM5 P41594 6/20 0.33
BRD4 O60885 1/20 0.33
BRD2 P25440 1/20 0.33
BRD3 Q15059 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
BAZ2A Q9UIF9 1/20 0.33
LMNA P02545 1/20 0.33
F10 P00742 1/20 0.31
ADORA1 P30542 1/20 0.31
SCN9A Q15858 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
SCHEMBL3665535 0.83 GRIA1 (0.41) GRIA1GRIA3PDE4DGLAKDM4E
SCHEMBL1891956 0.72 GRIA1 (0.70) GRIA1GRIA3PDE4DGLAKDM4E
SCHEMBL1882179 0.69 GRIA1 (0.59) GRIA1GRIA3PDE4DGRM5MAPT
Water SCHEMBL4777578 0.67 GRIA1 (0.56) GRIA1GRIA3PDE4DGRM5
SCHEMBL2918046 0.67 GRIA1 (0.56) GRIA1GRIA3PDE4DGRM5
SCHEMBL2926367 0.67 GRIA1 (0.44) GRIA1GRIA3PDE4DGLAKDM4E
SCHEMBL3668801 0.66 GRIA1 (0.45) GRIA1GRIA3PDE4DGRM5
SCHEMBL4779376 0.65 CYP2A6 (0.42) GLAKDM4EALDH1A1GAAHPGD
SCHEMBL5534283 0.65 KDM4E (0.43) GLAKDM4EALDH1A1HCRTR1GAA
SCHEMBL3665537 0.65 SMN1; SMN2 (0.35) GRIA1GRIA3PDE4DGLAKDM4E

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
EP-2222296-A2 AMPA RECEPTOR ANTAGONISTS AND ZONISAMIDE FOR EPILEPSY Eisai R&D Management Co., Ltd. (JP) 2010-09-01 EP disclosed
WO-2009082038-A2 AMPA RECEPTOR ANTAGONISTS AND ZONISAMIDE FOR EPILEPSY EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-07-02 WO disclosed