SCHEMBL7313463

SCHEMBL7313463

CN(C)c1ccccc1NC(=O)CN1Cc2ccc(OCCC(C(N)=O)N3CCc4ccccc43)cc2N=C1NC(=O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.35
PDE4B Q07343 2/20 0.35
PDE4C Q08493 2/20 0.35
PDE4D Q08499 2/20 0.35
MAPT P10636 8/20 0.35
TP53 P04637 4/20 0.35
LMNA P02545 3/20 0.35
ITGA4 P13612 2/20 0.35
ITGB7 P26010 2/20 0.35
POLB P06746 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TNF P01375 1/20 0.33
PRMT5 O14744 2/20 0.32
TSHR P16473 1/20 0.31
ATM Q13315 1/20 0.31
GAA P10253 1/20 0.31
WDR77 Q9BQA1 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
SCHEMBL7351300 0.91 LCK (0.36) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7317733 0.91 ALDH1A1 (0.38) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7320735 0.90 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DITGA4
SCHEMBL7311535 0.90 MAPT (0.37) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7319179 0.81 LCK (0.36) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7311511 0.81 ALDH1A1 (0.35) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7311435 0.78 PDE4A (0.39) PDE4APDE4BPDE4CPDE4D
SCHEMBL7311541 0.76 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7310878 0.74 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7307657 0.73 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DLMNA

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