SCHEMBL7311541

SCHEMBL7311541

CN(C)c1ccccc1OC(=O)CN1Cc2ccc(OCCCC(=O)NN3CCc4ccccc43)cc2N=C1NC(=O)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.38
PDE4B Q07343 8/20 0.38
PDE4C Q08493 8/20 0.38
PDE4D Q08499 8/20 0.38
PRMT5 O14744 4/20 0.34
ADRA1D P25100 4/20 0.33
ADRA1A P35348 4/20 0.33
ADRA1B P35368 4/20 0.33
WDR77 Q9BQA1 3/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
CACNA1B Q00975 1/20 0.32
KDM1A O60341 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL7319183 0.91 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DMAOB
SCHEMBL7311518 0.91 ALDH1A1 (0.37) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7311440 0.89 PDE4A (0.43) PDE4APDE4BPDE4CPDE4D
SCHEMBL7311535 0.85 MAPT (0.37) PDE4APDE4BPDE4CPDE4DPRMT5
SCHEMBL7313455 0.84 PDE4A (0.36) PDE4APDE4BPDE4CPDE4DPRMT5
SCHEMBL7311511 0.76 ALDH1A1 (0.35) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7319179 0.76 LCK (0.36) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7313463 0.76 PDE4A (0.35) PDE4APDE4BPDE4CPDE4DPRMT5
SCHEMBL7317727 0.75 ALDH1A1 (0.37) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7351296 0.75 PDE4A (0.36) PDE4APDE4BPDE4CPDE4D

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
US-4739056-A ENZYME INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-04-19 US disclosed