SCHEMBL7316529

SCHEMBL7316529

CN(C)c1ccccc1OC(=O)CN1Cc2cccc(OCCCC(=O)N(Cc3ccccc3)Cc3ccccc3)c2N=C1NC(=O)Nc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
PDE4A P27815 6/20 0.34
PDE4B Q07343 6/20 0.34
PDE4C Q08493 6/20 0.34
PDE4D Q08499 6/20 0.34
LMNA P02545 2/20 0.34
NPC1 O15118 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
S1PR1 P21453 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
PPIA P62937 2/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
NAMPT P43490 4/20 0.32

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
SCHEMBL7316080 0.92 PDE3B (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7310529 0.91 PDE3B (0.35) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7318132 0.90 NPC1 (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7312004 0.86 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313872 0.86 PDE3B (0.37) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7306654 0.85 PDE3B (0.34) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7312876 0.82 PDE3B (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7317853 0.81 KCNQ2 (0.39) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7316967 0.81 TSHR (0.37) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313053 0.79 PDE3B (0.38) 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