SCHEMBL7363892

SCHEMBL7363892

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

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.71
PDE4B Q07343 4/20 0.71
PDE4C Q08493 4/20 0.71
PDE4D Q08499 4/20 0.71
PDE3B Q13370 1/20 0.71
PDE3A Q14432 1/20 0.71
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP2C19 P33261 1/20 0.44
PARP1 P09874 2/20 0.44
ADRA1A P35348 2/20 0.41
HRH1 P35367 2/20 0.41
ADRA1B P35368 2/20 0.41
KCNH2 Q12809 2/20 0.41
HRH3 Q9Y5N1 2/20 0.41
TBXAS1 P24557 1/20 0.40
MCHR1 Q99705 1/20 0.40
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL7370212 0.91 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7363454 0.91 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7368038 0.84 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7365957 0.84 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7360454 0.84 PDE4A (0.67) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7364942 0.83 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7363999 0.82 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL8694738 0.82 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7360186 0.81 PDE4A (0.61) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7370566 0.81 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0612321-B1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX INC (US) 1999-08-25 EP disclosed
EP-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
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