SCHEMBL8286376

SCHEMBL8286376

CC(=O)CCc1cc(C)nc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.45
POLB P06746 1/20 0.40
MAPT P10636 6/20 0.37
KDM4E B2RXH2 5/20 0.37
ALDH1A1 P00352 5/20 0.37
GAA P10253 5/20 0.37
HPGD P15428 4/20 0.37
LMNA P02545 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
CLK1 P49759 1/20 0.37
RAB9A P51151 1/20 0.37
MAPK1 P28482 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
ATM Q13315 1/20 0.36
GFER P55789 1/20 0.36
CSF1R P07333 1/20 0.35

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
SCHEMBL8285245 0.93 PDE11A (0.46) PDE11APOLBMAPTKDM4EALDH1A1
SCHEMBL8286391 0.90 PDE11A (0.44) PDE11APOLBMAPTKDM4EALDH1A1
SCHEMBL8286380 0.90 PDE11A (0.44) PDE11AMAPTKDM4EALDH1A1GAA
SCHEMBL8286381 0.87 PDE11A (0.45) PDE11APOLBMAPTKDM4EALDH1A1
SCHEMBL8287467 0.86 PDE11A (0.45) PDE11AMAPTKDM4EALDH1A1GAA
SCHEMBL8285248 0.84 PDE11A (0.46) PDE11APOLBMAPTKDM4EALDH1A1
SCHEMBL8285190 0.84 PDE11A (0.39) PDE11APOLBMAPTKDM4EALDH1A1
SCHEMBL8287604 0.82 PDE11A (0.37) PDE11APOLBMAPTKDM4EALDH1A1
SCHEMBL8285149 0.81 PDE11A (0.47) PDE11APOLBMAPTKDM4EALDH1A1
SCHEMBL8286440 0.81 PDE11A (0.48) PDE11APOLBMAPTKDM4EALDH1A1

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
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