SCHEMBL5756906

SCHEMBL5756906

CCCCn1cc(C(=O)NCc2ccc(Br)cc2)c(=O)n(-c2cccc(C#N)c2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.43
CNR1 P21554 8/20 0.43
KLKB1 P03952 2/20 0.40
KLK1 P06870 2/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
ELANE P08246 3/20 0.37

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
SCHEMBL5757494 0.92 CNR2 (0.42) CNR2CNR1KLKB1KLK1MEN1
SCHEMBL5758877 0.92 CNR2 (0.45) CNR2CNR1KLKB1KLK1DRD2
SCHEMBL5758356 0.92 PDE10A (0.43) CNR2CNR1KLKB1KLK1ELANE
SCHEMBL5760152 0.92 CNR1 (0.43) CNR2CNR1KLKB1KLK1LMNA
SCHEMBL27624389 0.91 CNR2 (0.42) CNR2CNR1KLKB1KLK1DRD2
SCHEMBL5758836 0.90 TP53 (0.48) CNR2CNR1KLKB1KLK1MEN1
SCHEMBL5759860 0.90 CNR2 (0.45) CNR2CNR1KLKB1KLK1LMNA
SCHEMBL5758190 0.89 ELANE (0.49) CNR2CNR1KLKB1KLK1ELANE
SCHEMBL5757562 0.88 CNR1 (0.49) CNR2CNR1KLKB1KLK1KMT2A
SCHEMBL5755575 0.88 PDE10A (0.45) CNR2CNR1KLKB1KLK1DRD2

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 CNR2 2164/4885CNR1 2232/4885KLKB1 262/4885

“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.