SCHEMBL4848978

SCHEMBL4848978

O=C(O)c1ccc(CNC(=O)c2cc(-c3ccncc3)n[nH]c2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.61
CASP1 P29466 1/20 0.51
ROCK2 O75116 2/20 0.51
PRKCA P17252 1/20 0.51
GRK2 P25098 1/20 0.51
MAPK1 P28482 2/20 0.49
MAPK3 P27361 1/20 0.49
MAP4K4 O95819 2/20 0.48
PRKACA P17612 2/20 0.48
CLK4 Q9HAZ1 2/20 0.48
RPS6KA5 O75582 1/20 0.48
PRKCG P05129 1/20 0.48
RPS6KB1 P23443 1/20 0.48
AKT1 P31749 1/20 0.48
GSK3A P49840 1/20 0.48
PRKX P51817 1/20 0.48
PRKCD Q05655 1/20 0.48
PRKG2 Q13237 1/20 0.48
ROCK1 Q13464 1/20 0.48
DYRK1A Q13627 1/20 0.48

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
SCHEMBL4856282 0.91 GSK3B (0.69) GSK3BCASP1ROCK2PRKCAGRK2
SCHEMBL4853003 0.90 GSK3B (0.65) GSK3BCASP1ROCK2PRKCAGRK2
SCHEMBL4856466 0.89 GSK3B (0.64) GSK3BCASP1ROCK2PRKCAGRK2
SCHEMBL4851380 0.88 GSK3B (0.58) GSK3BCASP1ROCK2PRKCAGRK2
SCHEMBL4855854 0.88 GSK3B (0.58) GSK3BCASP1ROCK2PRKCAGRK2
SCHEMBL4856002 0.88 GSK3B (0.70) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL4848952 0.88 GSK3B (0.62) GSK3BCASP1ROCK2PRKCAGRK2
SCHEMBL4856280 0.88 GSK3B (0.75) GSK3BCASP1ROCK2PRKCAGRK2
SCHEMBL4848500 0.88 GSK3B (0.62) GSK3BCASP1ROCK2PRKCAGRK2
SCHEMBL4856682 0.88 GSK3B (0.69) GSK3BCASP1ROCK2PRKCAGRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7462613-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-09 US disclosed
US-7462613-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-09 US disclosed
US-7462613-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-09 US disclosed
US-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed
US-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed
US-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed
EP-1611121-B1 PYRIDAZINONE DERIVATIVES AS CDK2-INHIBITORS AVENTIS PHARMA SA (FR) 2007-08-08 EP disclosed
EP-1581505-B1 PYRIDAZINONE DERIVATIVES AS GSK-3BETA INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2007-08-01 EP disclosed
US-20050026918-A1 Novel pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-02-03 US 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 (1 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-20050026918-A1 Novel pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them C5, ADRA2C, ADRA1A GSK3B 3708/4885CASP1 3371/4885ROCK2 4122/4885

“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.