SCHEMBL4707608

SCHEMBL4707608

CC(=O)c1c(-c2ccc(F)cc2)nn(CC2CC2)c(=O)c1Nc1cccc(C#N)c1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC34A1 Q06495 13/20 0.45
BRD4 O60885 1/20 0.43
CREBBP Q92793 1/20 0.43
PDE4B Q07343 1/20 0.43
ACHE P22303 1/20 0.41
BACE1 P56817 1/20 0.41
MCHR1 Q99705 2/20 0.40
HTR2A P28223 1/20 0.40
CCR3 P51677 1/20 0.40

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
SCHEMBL4706654 0.92 PDE4B (0.52) SLC34A1BRD4CREBBPPDE4BACHE
SCHEMBL3032602 0.91 PDE4B (0.44) SLC34A1BRD4CREBBPPDE4BACHE
SCHEMBL4707585 0.89 PDE4B (0.55) SLC34A1PDE4BACHEBACE1MCHR1
SCHEMBL4708006 0.88 PDE4A (0.47) SLC34A1BRD4CREBBPPDE4BACHE
SCHEMBL3037450 0.87 BRD4 (0.45) SLC34A1BRD4CREBBPPDE4BACHE
SCHEMBL4708332 0.86 PDE4B (0.46) SLC34A1BRD4CREBBPPDE4BMCHR1
SCHEMBL4708371 0.84 PDE4B (0.54) SLC34A1BRD4CREBBPPDE4BMCHR1
SCHEMBL1652321 0.84 BRD4 (0.43) SLC34A1BRD4CREBBPPDE4BACHE
SCHEMBL1653014 0.83 PDE4B (0.46) SLC34A1BRD4CREBBPPDE4BMCHR1
SCHEMBL4706044 0.81 PDE4B (0.55) PDE4BACHEBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459453-B2 Pyridazin-3(2H)-one derivatives as PDE4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2008-12-02 US disclosed
US-20080269235-A1 PYRIDAZIN-3 (2H) -ONE DERIVATIVES AS PDE4 INHIBITORS DAL PIAZ VITTORIO 2008-10-30 US disclosed
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2006-03-09 US disclosed
EP-1503992-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE4 INHIBITORS Almirall Prodesfarma, S.A. (ES) 2005-02-09 EP disclosed
WO-2003097613-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE4 INHIBITORS ALMIRALL PRODESFARMA SA (ES) 2003-11-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269235-A1 PYRIDAZIN-3 (2H) -ONE DERIVATIVES AS PDE4 INHIBITORS PDE4A, PDE3A, PDE4B SLC34A1 1806/4885BRD4 467/4885CREBBP 1695/4885
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors PDE4A, PDE3A, PDE4B SLC34A1 1806/4885BRD4 467/4885CREBBP 1695/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.