SCHEMBL7146846

SCHEMBL7146846

COc1ccc(CN2N=C(c3ccc(OC)c(OC)c3)[C@@H]3CCCC[C@@H]3C2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 20/20 1.00
PDE4A P27815 19/20 1.00
PDE4B Q07343 19/20 1.00
PDE4C Q08493 19/20 1.00

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
SCHEMBL7146855 1.00 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL7146851 1.00 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL4116272 0.92 PDE4D (0.85) PDE4DPDE4APDE4BPDE4C
SCHEMBL4116273 0.92 PDE4D (0.85) PDE4DPDE4APDE4BPDE4C
SCHEMBL4116270 0.92 PDE4D (0.85) PDE4DPDE4APDE4BPDE4C
SCHEMBL7141941 0.92 PDE4A (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL7141948 0.92 PDE4A (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL7141946 0.92 PDE4A (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL7145537 0.91 PDE4A (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL7145539 0.91 PDE4A (1.00) PDE4DPDE4APDE4BPDE4C

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
EP-0971901-B1 PHTHALAZINONES ALTANA PHARMA AG (DE) 2003-02-26 EP disclosed
US-6103718-A Phthalazinones BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-08-15 US disclosed
EP-0971901-A1 PHTHALAZINONES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2000-01-19 EP disclosed
WO-1998031674-A1 PHTHALAZINONES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-07-23 WO disclosed