SCHEMBL7303658

SCHEMBL7303658

CN(Cc1ccccc1)C(=O)CCCOc1cccc2c1N=C(NC(=O)Oc1ccccc1)N(CC(=O)Oc1ccccc1Cl)C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
PDE4A P27815 6/20 0.35
PDE4B Q07343 6/20 0.35
PDE4C Q08493 6/20 0.35
PDE4D Q08499 6/20 0.35
ACKR3 P25106 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 4/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPK1 P28482 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ACHE P22303 2/20 0.33
MAPT P10636 1/20 0.33
ATM Q13315 1/20 0.33
LMNA P02545 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL7314019 0.91 PDE3B (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313053 0.91 PDE3B (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7317651 0.90 PDE3B (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313872 0.90 PDE3B (0.37) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7306426 0.86 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7318132 0.86 NPC1 (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7311655 0.81 PDE3B (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7320179 0.80 PDE4A (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7307830 0.79 PDE4A (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10652213 0.79 PDE4A (0.41) 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