SCHEMBL5757705

SCHEMBL5757705

Cc1ccc(C(=O)NCc2ccccc2)c(=O)n1-c1cccc(C#N)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.55
KLKB1 P03952 3/20 0.52
KLK1 P06870 2/20 0.52
NOTUM Q6P988 1/20 0.50
HTT P42858 1/20 0.45
HPGD P15428 2/20 0.44
CNR2 P34972 2/20 0.44
BRD4 O60885 1/20 0.43
MAOA P21397 1/20 0.43
PTGER1 P34995 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CNR1 P21554 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL5756911 0.93 ELANE (0.57) ELANEKLKB1KLK1NOTUMHPGD
SCHEMBL5756141 0.92 ELANE (0.52) ELANEKLKB1KLK1NOTUMHPGD
SCHEMBL5755817 0.92 ELANE (0.52) ELANEKLKB1KLK1NOTUMHPGD
SCHEMBL5761223 0.91 ELANE (0.55) ELANEKLKB1KLK1NOTUMHPGD
SCHEMBL5756660 0.91 ELANE (0.55) ELANEKLKB1KLK1NOTUMHPGD
SCHEMBL5757781 0.91 ELANE (0.53) ELANEKLKB1KLK1NOTUMPTGER1
SCHEMBL5755823 0.91 ELANE (0.58) ELANEKLKB1KLK1NOTUMHTT
SCHEMBL27643802 0.90 ELANE (0.54) ELANEKLKB1KLK1NOTUMHPGD
SCHEMBL5756946 0.90 ELANE (0.50) ELANEKLKB1KLK1NOTUMHPGD
SCHEMBL5757342 0.90 ELANE (0.50) ELANEKLKB1KLK1NOTUMPTGER1

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
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
EP-1562902-A1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE AstraZeneca AB (SE) 2005-08-17 EP disclosed
WO-2004043924-A1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2004-05-27 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 (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.