SCHEMBL5757494

SCHEMBL5757494

CCCCn1cc(C(=O)NCc2cccc(Br)c2)c(=O)n(-c2cccc(C#N)c2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.42
CNR1 P21554 7/20 0.42
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
KLKB1 P03952 1/20 0.38
KLK1 P06870 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
TP53 P04637 1/20 0.37
BRD4 O60885 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL5756906 0.92 CNR2 (0.43) CNR2CNR1SMN1; SMN2LMNAMEN1
SCHEMBL5758877 0.88 CNR2 (0.45) CNR2CNR1KLKB1KLK1DRD2
SCHEMBL5758764 0.88 CNR2 (0.48) CNR2CNR1MAPTKMT2AKLKB1
SCHEMBL5757562 0.88 CNR1 (0.49) CNR2CNR1KMT2AKLKB1KLK1
SCHEMBL5755575 0.88 PDE10A (0.45) CNR2CNR1KLKB1KLK1DRD2
SCHEMBL5759860 0.87 CNR2 (0.45) CNR2CNR1MAPTSMN1; SMN2LMNA
SCHEMBL5758356 0.87 PDE10A (0.43) CNR2CNR1KLKB1KLK1
SCHEMBL5760152 0.87 CNR1 (0.43) CNR2CNR1MAPTLMNAKLKB1
SCHEMBL27624389 0.87 CNR2 (0.42) CNR2CNR1KLKB1KLK1DRD2
SCHEMBL5760733 0.86 HPGD (0.52) CNR2CNR1MAPTLMNATP53

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 CNR2 2164/4885CNR1 2232/4885MAPT 1847/4885

“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.