SCHEMBL7318905

SCHEMBL7318905

CCOC(=O)NC1=Nc2cc(OCCCC(=O)NN3CCCCC3)ccc2CN1CC(=O)NCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.44
PDE4B Q07343 4/20 0.44
PDE4C Q08493 4/20 0.44
PDE4D Q08499 4/20 0.44
LMNA P02545 4/20 0.41
TP53 P04637 3/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 2/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
KDM1A O60341 1/20 0.36
MMP13 P45452 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL7316526 0.91 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7314040 0.91 LMNA (0.41) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7312716 0.90 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL7315023 0.89 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7321161 0.86 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7306174 0.85 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7318898 0.85 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7310461 0.84 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL7310210 0.82 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL7311023 0.82 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DCNR1

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