SCHEMBL8285251

SCHEMBL8285251

Cc1cc(C2CCCC2)c2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.48
MAT2A P31153 2/20 0.40
MAPK1 P28482 2/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 2/20 0.39
NPSR1 Q6W5P4 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.38
DRD1 P21728 2/20 0.38
DRD5 P21918 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
GSK3B P49841 3/20 0.37
PIK3CA P42336 1/20 0.37
PRKDC P78527 1/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
HTT P42858 2/20 0.37
CDK4 P11802 4/20 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
SCHEMBL8285198 0.85 PDE11A (0.45) PDE11AMAPK1GAAHPGDNPSR1
SCHEMBL8286406 0.85 PDE11A (0.44) PDE11AMAPK1GAAHPGDNPSR1
SCHEMBL8358812 0.84 PDE11A (0.46) PDE11AMAPK1GAAHPGDPOLB
SCHEMBL8285163 0.84 POLB (0.50) PDE11AMAPK1GAAHPGDNPSR1
SCHEMBL8287407 0.83 PDE11A (0.43) PDE11AMAPK1GAAHPGDNPSR1
SCHEMBL8287203 0.83 PDE11A (0.40) PDE11AMAT2AMAPK1GAAHPGD
SCHEMBL5871846 0.83 PDE11A (0.49) PDE11AMAPK1GAAHPGDNPSR1
SCHEMBL8285238 0.83 PDE11A (0.49) PDE11AMAPK1GAAHPGDNPSR1
SCHEMBL8286427 0.82 RAB9A (0.51) PDE11AHPGDKDM4EATMPOLB
SCHEMBL8287233 0.82 PDE11A (0.40) PDE11AMAT2AMAPK1GAAHPGD

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