SCHEMBL8286573

SCHEMBL8286573

Cc1cc2c(c(O)n1)c(=O)cc(Nc1ccccc1)n2-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.42
HPGD P15428 3/20 0.42
MAPK1 P28482 3/20 0.42
PDE11A Q9HCR9 1/20 0.42
GFER P55789 1/20 0.41
CYP1A2 P05177 1/20 0.40
AHR P35869 1/20 0.40
NPSR1 Q6W5P4 4/20 0.40
ALDH1A1 P00352 3/20 0.40
HTT P42858 3/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 2/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 3/20 0.38
GSK3B P49841 1/20 0.37
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
NPC1 O15118 2/20 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
SCHEMBL5872108 0.88 GAA (0.44) GAAHPGDMAPK1PDE11AGFER
SCHEMBL8287944 0.87 GAA (0.43) GAAHPGDMAPK1PDE11AGFER
SCHEMBL5871645 0.86 GAA (0.42) GAAHPGDMAPK1PDE11AGFER
SCHEMBL5871824 0.86 GAA (0.44) GAAHPGDMAPK1PDE11AGFER
SCHEMBL8287934 0.86 MAT2A (0.43) GAAHPGDMAPK1PDE11AGFER
SCHEMBL8287190 0.85 PDE11A (0.40) GAAHPGDMAPK1PDE11AGFER
SCHEMBL5872094 0.85 PDE11A (0.40) GAAHPGDMAPK1PDE11AGFER
SCHEMBL5872043 0.85 GAA (0.41) GAAHPGDMAPK1PDE11AGFER
SCHEMBL8287996 0.84 MAPT (0.43) GAAHPGDMAPK1PDE11AGFER
SCHEMBL8286146 0.84 PDE11A (0.39) GAAHPGDMAPK1PDE11AGFER

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-2005091857-A2 1,6-NAPHTHYRIDINE AND 1,8-NAPHTHYRIDINE DERIVATIVES AND THEIR USE TO TREAT DIABETES AND RELATED DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2005-10-06 WO disclosed
WO-2003027112-A1 1, 8-NAPHTHYRIDINE DERIVATIVES AS ANTIDIABETICS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 WO disclosed