SCHEMBL7306528

SCHEMBL7306528

CCn1nc(-c2cccc(Br)c2)cc(Nc2cccc3ncccc23)c1=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 11/20 0.52
EGFR P00533 2/20 0.42
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 3/20 0.41
HTT P42858 2/20 0.41
HTR2C P28335 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
ADORA1 P30542 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL7309612 0.94 PDE4B (0.52) PDE4BEGFRMAPTLMNAHTT
SCHEMBL4052027 0.90 PDE4B (0.54) PDE4BKDM4ELMNAHTTHTR2C
SCHEMBL4049841 0.88 TBXAS1 (0.49) PDE4BLMNAHTTHTR2CMEN1
SCHEMBL4056450 0.87 PDE4B (0.46) PDE4BLMNAHTTHTR2CMEN1
SCHEMBL4050499 0.86 PDE4B (0.46) PDE4BLMNAHTTHTR2CMEN1
SCHEMBL7314230 0.85 PDE4B (0.52) PDE4BADORA2AADORA2BADORA1
SCHEMBL4055355 0.84 RECQL (0.51) PDE4BHTT
SCHEMBL7308904 0.84 PDE4B (0.56) PDE4BMEN1KMT2AADORA2AADORA2B
SCHEMBL7304940 0.83 PDE4B (0.59) PDE4BADORA2AADORA2BADORA1
SCHEMBL7316189 0.83 PDE4B (0.57) PDE4BKDM4EMAPTLMNAHTT

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-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