SCHEMBL7368038

SCHEMBL7368038

CCCn1nc(-c2cccc(OC)c2)c2ncccc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 5/20 0.52
PDE4B Q07343 3/20 0.52
PDE4C Q08493 3/20 0.52
PDE4D Q08499 3/20 0.52
PDE3B Q13370 1/20 0.52
PDE3A Q14432 1/20 0.52
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
BRD4 O60885 1/20 0.43
KAT2B Q92831 2/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
DYRK1A Q13627 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
MAOB P27338 1/20 0.42
JAK2 O60674 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
TOP1 P11387 1/20 0.40

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
SCHEMBL7366044 0.91 TP53 (0.45) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7365100 0.91 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7369334 0.88 ALDH1A1 (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7366870 0.85 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7363892 0.84 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7366158 0.84 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7367898 0.82 TBXAS1 (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7365112 0.81 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7368033 0.80 PIK3CD (0.50) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7370566 0.79 MEN1 (0.51) PDE4APDE4BPDE4CPDE4DPDE3B

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
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed