SCHEMBL10760024

SCHEMBL10760024

COc1ccc(-c2ccc(=S)[nH]n2)cc1OC(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.56
PDE4B Q07343 4/20 0.56
PDE4C Q08493 4/20 0.56
PDE4D Q08499 4/20 0.56
PDE3B Q13370 3/20 0.56
PDE3A Q14432 3/20 0.56
SMN1; SMN2 Q16637 5/20 0.50
MAPK1 P28482 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
MAPT P10636 5/20 0.44
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42

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
SCHEMBL10761953 0.84 PDE4B (0.79) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10762505 0.83 PDE4A (0.51) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10758184 0.81 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10761773 0.81 XDH (0.54) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10764347 0.78 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10759046 0.76 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL9186261 0.72 PDE4B (0.43) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL9267049 0.72 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10779323 0.72 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10966477 0.71 LMNA (0.65) SMN1; SMN2MAPK1LMNAHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4707481-A Pyridazinones, their preparation and use, and bronchospasmolytic medicaments containing pyridazinones BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1987-11-17 US disclosed
EP-0125636-B1 PYRIDAZINONES, THEIR PREPARATION AND USE, MEDICINES CONTAINING THESE PYRIDAZINONES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1987-04-01 EP disclosed
WO-1984004521-A1 PYRIDAZINONES, THEIR PREPARATION AND USE, AND MEDICAMENTS CONTAINING PYRIDAZINONES BYK GULDEN LOMBERG CHEM FAB (DE) 1984-11-22 WO disclosed
EP-0125636-A1 Pyridazinones, their preparation and use, medicines containing these pyridazinones Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1984-11-21 EP disclosed