SCHEMBL3129659

SCHEMBL3129659

CCOc1cc(C(N)c2ocnc2C)ccc1OC(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.38
LMNA P02545 3/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PDE4A P27815 6/20 0.33
MBOAT4 Q96T53 3/20 0.33
F7 P08709 3/20 0.31
KCNH2 Q12809 1/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL3130706 0.80 AAK1 (0.39) PDE4BLMNAMEN1MAPTMAPK1
SCHEMBL3129614 0.76 PDE4B (0.40) PDE4BLMNAMEN1MAPTMAPK1
SCHEMBL3200134 0.73 SLC6A2 (0.43) PDE4BLMNAMAPTMAPK1KMT2A
SCHEMBL3131252 0.73 ATM (0.41) PDE4BLMNAMEN1MAPTMAPK1
SCHEMBL3201429 0.72 PDE4B (0.38) PDE4BLMNAMEN1MAPTMAPK1
SCHEMBL3129664 0.71 MAPT (0.41) PDE4BLMNAMEN1MAPTMAPK1
SCHEMBL16951534 0.70 RAB9A (0.40) PDE4BLMNAMEN1MAPTMAPK1
SCHEMBL16956686 0.69 MAPT (0.46) PDE4BLMNAMEN1MAPTMAPK1
SCHEMBL3129261 0.69 AAK1 (0.39) LMNAMEN1MAPTMAPK1KMT2A
SCHEMBL1143506 0.68 PDE4B (0.51) PDE4BLMNAMEN1MAPTMAPK1

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-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO disclosed