SCHEMBL5757208

SCHEMBL5757208

Cc1ccc(C(=O)NCc2ccc(-n3cccn3)cc2)c(=O)n1-c1cccc(C#N)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.50
KLKB1 P03952 3/20 0.45
KLK1 P06870 2/20 0.45
TNKS O95271 1/20 0.44
PARP1 P09874 1/20 0.44
TNKS2 Q9H2K2 1/20 0.44
SCN9A Q15858 3/20 0.41
NOTUM Q6P988 1/20 0.40
EGLN1 Q9GZT9 2/20 0.40
PI4KB Q9UBF8 1/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
FLT3 P36888 1/20 0.38
TYRO3 Q06418 1/20 0.38
MERTK Q12866 1/20 0.38
GAS6 Q14393 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
SCHEMBL5755823 0.86 ELANE (0.58) ELANEKLKB1KLK1NOTUMLMNA
SCHEMBL5757781 0.86 ELANE (0.53) ELANEKLKB1KLK1NOTUMLMNA
SCHEMBL5756911 0.86 ELANE (0.57) ELANEKLKB1KLK1NOTUMLMNA
SCHEMBL5757705 0.85 ELANE (0.55) ELANEKLKB1KLK1NOTUMALDH1A1
SCHEMBL5757950 0.85 ELANE (0.69) ELANETNKSPARP1TNKS2EGLN1
SCHEMBL5761223 0.85 ELANE (0.55) ELANEKLKB1KLK1NOTUMLMNA
SCHEMBL5756660 0.85 ELANE (0.55) ELANEKLKB1KLK1NOTUMLMNA
SCHEMBL27643802 0.84 ELANE (0.54) ELANEKLKB1KLK1NOTUM
SCHEMBL5755175 0.84 FLT3 (0.43) KLKB1KLK1TNKSPARP1TNKS2
SCHEMBL5755885 0.83 ELANE (0.54) ELANEKLKB1KLK1NOTUMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562902-B1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2006-05-03 EP disclosed
US-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase ASRAZENECA AB (SE) 2006-02-16 US disclosed
CN-1711243-A 2-pyridone derivatives as inhibitors of neutrophil elastase ASTRAZENECA AB (SE) 2005-12-21 CN 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-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase SERPINB1, ELANE, SERPINE1 ELANE 2/4885KLKB1 262/4885KLK1 329/4885

“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.