SCHEMBL7367898

SCHEMBL7367898

CCn1nc(-c2cccc(OC)c2)c2cccnc2c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.48
KAT2B Q92831 2/20 0.44
DYRK1A Q13627 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
PDE4A P27815 5/20 0.43
PDE4B Q07343 3/20 0.43
PDE4C Q08493 3/20 0.43
PDE4D Q08499 3/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
MAOB P27338 1/20 0.43
BRD4 O60885 1/20 0.42
JAK2 O60674 1/20 0.41
TOP1 P11387 1/20 0.41
GLO1 Q04760 1/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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) KAT2BDYRK1ACLK4PDE4APDE4B
SCHEMBL7365100 0.91 PDE4A (0.53) TBXAS1KAT2BDYRK1ACLK4PDE4A
SCHEMBL7365028 0.87 KDM4E (0.50) TBXAS1KAT2BCLK4PDE4APDE4B
SCHEMBL7370925 0.87 PDE4A (0.55) KAT2BPDE4APDE4BPDE4CPDE4D
SCHEMBL7361958 0.86 PDE4A (0.62) KAT2BPDE4APDE4BPDE4CPDE4D
SCHEMBL7360186 0.84 PDE4A (0.61) TBXAS1PDE4APDE4BPDE4CPDE4D
SCHEMBL7364120 0.84 TBXAS1 (0.50) TBXAS1PDE4APDE4BPDE4CPDE4D
SCHEMBL8699836 0.83 TBXAS1 (0.45) TBXAS1KAT2BPDE4APDE4BPDE4C
SCHEMBL7368038 0.82 PDE4A (0.52) KAT2BDYRK1ACLK4PDE4APDE4B
SCHEMBL7366042 0.82 PIK3CD (0.50) KAT2BDYRK1ACLK4PDE4APDE4B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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