SCHEMBL4707779

SCHEMBL4707779

CCn1nc(-c2ccccc2)c(C(C)=O)c(Nc2ccc(SC)cc2)c1=O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.77
SMN1; SMN2 Q16637 1/20 0.44
GSK3B P49841 2/20 0.41
CSF1R P07333 1/20 0.41
FGFR1 P11362 1/20 0.41
FLT1 P17948 1/20 0.41
KDR P35968 1/20 0.41
CSNK1A1 P48729 1/20 0.41
CDK8 P49336 1/20 0.41
GSK3A P49840 1/20 0.41
CDK5 Q00535 1/20 0.41
PRKCQ Q04759 1/20 0.41
LRRK2 Q5S007 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
TP53 P04637 1/20 0.41
ADORA3 P0DMS8 1/20 0.40
ADORA1 P30542 1/20 0.40
HTR1A P08908 2/20 0.40
ADRA1D P25100 2/20 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
SCHEMBL4705654 0.91 PDE4B (0.80) PDE4BSMN1; SMN2TP53
SCHEMBL4706133 0.90 PDE4B (0.85) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1
SCHEMBL4707226 0.89 PDE4B (0.67) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1
SCHEMBL4708322 0.88 PDE4B (0.90) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1
SCHEMBL4707595 0.88 PDE4B (0.82) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1
SCHEMBL4707416 0.87 PDE4B (0.80) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1
SCHEMBL4706447 0.87 PDE4B (0.80) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1
SCHEMBL4708776 0.87 PDE4B (0.80) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1
SCHEMBL4708354 0.87 PDE4B (1.00) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1
SCHEMBL4708696 0.87 PDE4B (0.80) PDE4BSMN1; SMN2GSK3BCSF1RFGFR1

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 claimed
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2006-03-09 US claimed
US-20080269235-A1 PYRIDAZIN-3 (2H) -ONE DERIVATIVES AS PDE4 INHIBITORS DAL PIAZ VITTORIO 2008-10-30 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 PDE4B 3/4885SMN1; SMN2 2927/4885GSK3B 565/4885
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors PDE4A, PDE3A, PDE4B PDE4B 3/4885SMN1; SMN2 2927/4885GSK3B 565/4885

“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.