SCHEMBL6187425

SCHEMBL6187425

CCn1nc(-c2ccccc2)c(C(C)=O)c(Nc2ccsc2)c1=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.71
ADORA3 P0DMS8 1/20 0.45
ADORA1 P30542 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
PDE4A P27815 3/20 0.42
PDE4C Q08493 3/20 0.42
PDE4D Q08499 3/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
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
GSK3B P49841 1/20 0.41
CDK5 Q00535 1/20 0.41
PRKCQ Q04759 1/20 0.41
LRRK2 Q5S007 1/20 0.41

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
SCHEMBL4706133 0.86 PDE4B (0.85) PDE4BADORA3ADORA1SMN1; SMN2PDE4A
SCHEMBL4707595 0.84 PDE4B (0.82) PDE4BSMN1; SMN2PDE4APDE4CPDE4D
SCHEMBL1654205 0.84 PDE4B (0.78) PDE4BADORA3ADORA1SMN1; SMN2PDE4A
SCHEMBL4708322 0.84 PDE4B (0.90) PDE4BADORA3ADORA1SMN1; SMN2CSF1R
SCHEMBL4706447 0.83 PDE4B (0.80) PDE4BSMN1; SMN2CSF1RFGFR1FLT1
SCHEMBL4708696 0.83 PDE4B (0.80) PDE4BADORA3ADORA1SMN1; SMN2CSF1R
SCHEMBL4708354 0.83 PDE4B (1.00) PDE4BADORA3ADORA1SMN1; SMN2PDE4A
SCHEMBL4707416 0.83 PDE4B (0.80) PDE4BADORA3ADORA1SMN1; SMN2CSF1R
SCHEMBL4708776 0.83 PDE4B (0.80) PDE4BSMN1; SMN2CSF1RFGFR1FLT1
SCHEMBL4679348 0.82 PDE4B (0.67) PDE4BADORA3ADORA1SMN1; SMN2PDE4A

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-1575926-A1 NEW PYRIDAZIN-3(2H)-ONE DERIVATIVES Almirall Prodesfarma, S.A. (ES) 2005-09-21 EP disclosed
WO-2004058729-A1 NEW PYRIDAZIN-3(2H)-ONE DERIVATIVES ALMIRALL PRODESFARMA SA (ES) 2004-07-15 WO disclosed