SCHEMBL8285233

SCHEMBL8285233

Cc1nc2c(cc1CC(C)C)c(=O)cc(Nc1ccccc1)n2-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.39
GSK3B P49841 3/20 0.37
DRD1 P21728 2/20 0.36
DRD5 P21918 2/20 0.36
GAA P10253 3/20 0.36
HPGD P15428 2/20 0.36
MAPK1 P28482 2/20 0.36
HTT P42858 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
ALDH1A1 P00352 3/20 0.34
CDK4 P11802 3/20 0.34
CCND1 P24385 3/20 0.34
CCND2 P30279 3/20 0.34
CCND3 P30281 3/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL8285235 0.89 PDE11A (0.41) PDE11AGSK3BGAAHPGDMAPK1
SCHEMBL8287503 0.87 PDE11A (0.40) PDE11AGSK3BGAAHPGDMAPK1
SCHEMBL8286420 0.87 PDE11A (0.40) PDE11AGSK3BGAAHPGDMAPK1
SCHEMBL8287150 0.87 PDE11A (0.40) PDE11AGSK3BGAAHPGDMAPK1
SCHEMBL8285219 0.86 PDE11A (0.39) PDE11AGSK3BGAAHPGDMAPK1
SCHEMBL8286131 0.86 MAPT (0.42) PDE11AGSK3BGAAHPGDMAPK1
SCHEMBL8287892 0.85 PDE11A (0.39) PDE11AGSK3BGAAHPGDMAPK1
SCHEMBL8286404 0.84 PDE11A (0.40) PDE11AGSK3BDRD1DRD5GAA
SCHEMBL8287446 0.84 PDE11A (0.38) PDE11AGSK3BGAAHPGDMAPK1
SCHEMBL8286134 0.84 ALDH1A1 (0.39) PDE11AGSK3BGAAHPGDMAPK1

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