SCHEMBL8285339

SCHEMBL8285339

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
HTT P42858 3/20 0.42
ALDH1A1 P00352 5/20 0.41
LMNA P02545 4/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
USP2 O75604 1/20 0.41
ATM Q13315 1/20 0.41
HCRTR1 O43613 1/20 0.41
NOTUM Q6P988 1/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 2/20 0.39
MAPK1 P28482 2/20 0.39
HPGD P15428 2/20 0.39
ALOX12 P18054 1/20 0.39
NPC1 O15118 2/20 0.39
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL8286426 0.86 PDE11A (0.39) KDM4EHTTALDH1A1LMNANPSR1
SCHEMBL8286457 0.83 LMNA (0.38) HTTALDH1A1LMNAL3MBTL1NPSR1
SCHEMBL8286140 0.83 PDE11A (0.37) HTTALDH1A1LMNANPSR1USP2
SCHEMBL8285340 0.83 PDE11A (0.45) KDM4EALDH1A1LMNAL3MBTL1TP53
SCHEMBL8287417 0.83 HTT (0.47) KDM4EHTTALDH1A1LMNAL3MBTL1
SCHEMBL8286424 0.83 MAT2A (0.41) KDM4EHTTALDH1A1LMNANPSR1
SCHEMBL8286076 0.83 PDE11A (0.39) KDM4EHTTALDH1A1LMNANPSR1
SCHEMBL5872270 0.83 PDE11A (0.44) KDM4EHTTALDH1A1LMNAL3MBTL1
SCHEMBL8286083 0.82 PDE11A (0.38) KDM4EHTTALDH1A1LMNAL3MBTL1
SCHEMBL8286078 0.82 HTR6 (0.41) HTTALDH1A1LMNANPSR1MAPK1

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