SCHEMBL8569941

SCHEMBL8569941

CCOC(=O)c1ccc(OC)c2nc(CCc3ccccc3)[nH]c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.54
PDE4B Q07343 2/20 0.54
PDE4C Q08493 2/20 0.54
PDE4D Q08499 2/20 0.54
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MMP2 P08253 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
MAPT P10636 3/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 3/20 0.41
KDM4E B2RXH2 3/20 0.41

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
SCHEMBL1553518 0.90 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DMMP2
SCHEMBL1553391 0.88 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DMMP2
Hydrochloric Acid SCHEMBL8571356 0.86 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DMMP2
SCHEMBL8571347 0.85 PDE4D (0.59) PDE4APDE4BPDE4CPDE4DMMP2
SCHEMBL1553474 0.82 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL8570416 0.81 PDE4D (0.52) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL6942891 0.80 MAPT (0.47) MEN1KMT2AMMP2SMN1; SMN2MAPT
SCHEMBL1553610 0.79 PDE4A (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL8570317 0.79 PDE4D (0.52) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL8574189 0.79 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DMMP2

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-1998005327-A1 SUBSTITUTED AROMATIC COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-02-12 WO disclosed