SCHEMBL7319837

SCHEMBL7319837

CNC(=O)NC1=Nc2cccc(OCCCC(=O)N(C)c3ccccc3)c2CN1CC(=O)NCC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
NTSR1 P30989 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NOD2 Q9HC29 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL7316904 0.92 PDE3B (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7317240 0.88 PDE3B (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7317932 0.88 PDE3B (0.35) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7320607 0.87 PDE4A (0.42) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7312612 0.81 PDE4A (0.39) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7319810 0.80 PDE4A (0.39) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313246 0.78 PDE4A (0.37) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10669884 0.76 PDE4A (0.41) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10653884 0.76 PDE4A (0.42) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7318346 0.74 PDE4A (0.51) PDE3BPDE3APDE4APDE4BPDE4C

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