SCHEMBL7308383

SCHEMBL7308383

CN(C)c1ccccc1NC(=O)CN1Cc2c(cccc2OCCCC(=O)N(Cc2ccccc2)Cc2ccccc2)N=C1NC(=O)OC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.41
PDE3A Q14432 3/20 0.41
PDE4A P27815 8/20 0.38
PDE4B Q07343 8/20 0.38
PDE4C Q08493 8/20 0.38
PDE4D Q08499 8/20 0.38
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KCNQ2 O43526 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL7318644 0.87 PDE3B (0.35) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7316957 0.87 PDE3B (0.35) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313145 0.85 PDE4A (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7308378 0.85 PDE3B (0.39) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7319736 0.81 PDE3B (0.44) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7320482 0.81 NPC1 (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7309234 0.80 PDE3B (0.35) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7316967 0.79 TSHR (0.37) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7312876 0.78 PDE3B (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7317853 0.78 KCNQ2 (0.39) 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