SCHEMBL2782807

SCHEMBL2782807

O=c1ccc(-c2ccccn2)cn1-c1cccc(O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.42
GRIA3 P42263 1/20 0.42
PDE4D Q08499 1/20 0.42
FGFR1 P11362 1/20 0.42
OPRD1 P41143 3/20 0.41
GRM5 P41594 2/20 0.41
RET P07949 1/20 0.40
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
CAPN1 P07384 1/20 0.40
COMT P21964 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
MAPT P10636 1/20 0.39
MET P08581 1/20 0.39
HTR1A P08908 1/20 0.39
HTR7 P34969 1/20 0.39
KDM1A O60341 1/20 0.38
OPRM1 P35372 1/20 0.38
MIF P14174 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
SCHEMBL687912 0.84 GRIA1 (0.51) GRIA1GRIA3PDE4DGRM5MAPT
SCHEMBL1881456 0.81 GRIA1 (0.47) GRIA1GRIA3PDE4DFGFR1OPRD1
SCHEMBL1882491 0.77 GRIA1 (0.56) GRIA1GRIA3PDE4DFGFR1GRM5
SCHEMBL14889241 0.77 GRIA1 (0.62) GRIA1GRIA3PDE4DGRM5HTR1A
SCHEMBL1885107 0.76 SMN1; SMN2 (0.45) GRIA1GRIA3PDE4DFGFR1RET
SCHEMBL4466632 0.76 MCHR1 (0.43) GRIA1GRIA3PDE4DFGFR1ESR1
SCHEMBL4466635 0.76 ABL1 (0.39) GRIA1GRIA3PDE4DGRM5
SCHEMBL1884288 0.75 GRIA1 (0.60) GRIA1GRIA3PDE4DOPRD1GRM5
SCHEMBL4466629 0.75 PDE10A (0.41) GRIA1GRIA3PDE4DGRM5HTR1A
SCHEMBL10059952 0.75 HSD17B1 (0.48) OPRD1HSD17B1HSD17B2COMTESR1

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
EP-2177520-A1 1,5-Di(aryl or heteroaryl)-3-halo-2(1H)-pyridones as intermediates for the preparation of AMPA receptor inhibitors Eisai R&D Management Co., Ltd. (JP) 2010-04-21 EP disclosed