SCHEMBL8304547

SCHEMBL8304547

COC(=O)NC1CCc2cc(C3=NNC(=O)CC3)ccc2C1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 9/20 0.48
PDE3A Q14432 9/20 0.48
PDE4B Q07343 7/20 0.48
PDE4A P27815 6/20 0.48
PDE4C Q08493 6/20 0.48
PDE4D Q08499 6/20 0.48
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
ACHE P22303 3/20 0.43
MTNR1A P48039 2/20 0.41
MTNR1B P49286 2/20 0.41
LMNA P02545 1/20 0.39
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL8306755 0.81 MTNR1A (0.37) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL8912023 0.78 CA12 (0.49) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL9414809 0.78 PDE4B (0.35) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL9414695 0.78 PDE4B (0.35) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL8911889 0.77 CA12 (0.51) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL8302599 0.76 PDE3B (0.46) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL9414700 0.76 PDE3B (0.50) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL8911986 0.75 MAPT (0.42) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL8307326 0.75 HDAC8 (0.51) PDE3BPDE3APDE4BPDE4APDE4C
Iodide SCHEMBL8309296 0.75 PDE3B (0.49) PDE3BPDE3APDE4BPDE4APDE4C

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-0579059-B1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO (JP) 1999-05-12 EP disclosed
US-5739132-A ENDOTHOXIN SHOCK; NEPHRITIS TANABE SEIYAKU CO., LTD. (JP) 1998-04-14 US disclosed
EP-0579059-A1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1994-01-19 EP disclosed