SCHEMBL7311535

SCHEMBL7311535

CN(C)c1ccccc1OC(=O)CN1Cc2ccc(OCCC(C(N)=O)N3CCc4ccccc43)cc2N=C1NC(=O)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.37
TP53 P04637 5/20 0.37
LMNA P02545 4/20 0.37
POLB P06746 1/20 0.35
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
TNF P01375 1/20 0.33
PRMT5 O14744 2/20 0.32
GFER P55789 1/20 0.32
L3MBTL1 Q9Y468 2/20 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
SCHEMBL7311511 0.91 ALDH1A1 (0.35) MAPTTP53LMNAPOLBPDE4A
SCHEMBL7319179 0.91 LCK (0.36) MAPTTP53LMNAPDE4APDE4B
SCHEMBL7313463 0.90 PDE4A (0.35) MAPTTP53LMNAPOLBPDE4A
SCHEMBL7311435 0.89 PDE4A (0.39) PDE4APDE4BPDE4CPDE4D
SCHEMBL7311541 0.85 PDE4A (0.38) MAPTTP53LMNAPDE4APDE4B
SCHEMBL7317733 0.81 ALDH1A1 (0.38) MAPTTP53LMNAPDE4APDE4B
SCHEMBL7351300 0.81 LCK (0.36) MAPTTP53PDE4APDE4BPDE4C
SCHEMBL7320735 0.80 PDE4A (0.43) PDE4APDE4BPDE4CPDE4D
SCHEMBL7310878 0.77 PDE4A (0.41) MAPTTP53POLBPDE4APDE4B
SCHEMBL7311518 0.76 ALDH1A1 (0.37) MAPTTP53LMNAPDE4APDE4B

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