SCHEMBL7308904

SCHEMBL7308904

CCn1nc(-c2cccc(-c3cccc(C(N)=O)c3)c2)cc(Nc2cccc3ncccc23)c1=O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 16/20 0.56
RAF1 P04049 1/20 0.45
BRAF P15056 1/20 0.45
ADORA2A P29274 4/20 0.44
ADORA2B P29275 4/20 0.44
ADORA1 P30542 4/20 0.44
CLK1 P49759 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 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
SCHEMBL7314230 0.92 PDE4B (0.52) PDE4BADORA2AADORA2BADORA1CLK1
SCHEMBL7307576 0.90 PDE4B (0.48) PDE4BADORA2AADORA2BADORA1CLK1
SCHEMBL7309937 0.89 PDE4B (0.58) PDE4BADORA2AADORA2BADORA1MEN1
SCHEMBL7304940 0.89 PDE4B (0.59) PDE4BADORA2AADORA2BADORA1
SCHEMBL7310969 0.87 PDE4B (0.49) PDE4BADORA2AADORA2BADORA1CLK1
SCHEMBL7306806 0.87 PDE4B (0.62) PDE4BADORA2AADORA2BADORA1CLK1
SCHEMBL7315199 0.86 PDE4B (0.49) PDE4BADORA2AADORA2BADORA1
SCHEMBL7316189 0.86 PDE4B (0.57) PDE4BADORA2AADORA2BADORA1CLK1
SCHEMBL7319507 0.86 PDE4B (0.44) PDE4BADORA2AADORA2BADORA1
SCHEMBL7316781 0.86 PDE4B (0.48) PDE4BADORA2AADORA2BADORA1CLK1

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-2394998-A1 3-(5-Amino-6-oxo-1,6-dihydropyridazin-3-yl)-biphenyl derivatives as PDE4 inhibitors Almirall, S.A. (ES) 2011-12-14 EP claimed
EP-2394998-A1 3-(5-Amino-6-oxo-1,6-dihydropyridazin-3-yl)-biphenyl derivatives as PDE4 inhibitors Almirall, S.A. (ES) 2011-12-14 EP disclosed
EP-2394998-A1 3-(5-Amino-6-oxo-1,6-dihydropyridazin-3-yl)-biphenyl derivatives as PDE4 inhibitors Almirall, S.A. (ES) 2011-12-14 EP disclosed