SCHEMBL8287944

SCHEMBL8287944

Cc1cc2c(c(Nc3ccccc3)n1)c(=O)cc(Nc1ccccc1)n2-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.43
HPGD P15428 3/20 0.43
MAPK1 P28482 3/20 0.43
PDE11A Q9HCR9 1/20 0.42
ALDH1A1 P00352 4/20 0.40
NPSR1 Q6W5P4 3/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
GSK3B P49841 3/20 0.38
KDM4E B2RXH2 2/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GFER P55789 1/20 0.37
TSHR P16473 1/20 0.36
MAPT P10636 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
TP53 P04637 1/20 0.36
LOX P28300 1/20 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 0.89 GAA (0.44) GAAHPGDMAPK1PDE11AALDH1A1
SCHEMBL8287206 0.88 PDE11A (0.40) GAAHPGDMAPK1PDE11AALDH1A1
SCHEMBL8285359 0.88 KDM4E (0.47) GAAHPGDMAPK1PDE11ALMNA
SCHEMBL8285358 0.87 GAA (0.43) GAAHPGDPDE11AALDH1A1LMNA
SCHEMBL8358804 0.87 MAT2A (0.41) GAAHPGDMAPK1PDE11AALDH1A1
SCHEMBL5871824 0.87 GAA (0.44) GAAHPGDMAPK1PDE11AALDH1A1
SCHEMBL8287934 0.87 MAT2A (0.43) GAAHPGDMAPK1PDE11AALDH1A1
SCHEMBL8286573 0.87 GAA (0.42) GAAHPGDMAPK1PDE11AALDH1A1
SCHEMBL8287919 0.86 ALDH1A1 (0.41) GAAPDE11AALDH1A1GSK3BKDM4E
SCHEMBL8285272 0.86 PDE11A (0.37) GAAHPGDMAPK1PDE11AALDH1A1

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