SCHEMBL5755575

SCHEMBL5755575

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

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.45
CNR2 P34972 6/20 0.40
CNR1 P21554 6/20 0.40
METAP2 P50579 1/20 0.38
KLKB1 P03952 1/20 0.38
KLK1 P06870 1/20 0.38
PDPK1 O15530 3/20 0.37
MET P08581 1/20 0.37
ELANE P08246 1/20 0.37
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
FSCN1 Q16658 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
SCHEMBL5758356 0.92 PDE10A (0.43) PDE10ACNR2CNR1METAP2KLKB1
SCHEMBL5760152 0.90 CNR1 (0.43) CNR2CNR1METAP2KLKB1KLK1
SCHEMBL5758877 0.89 CNR2 (0.45) PDE10ACNR2CNR1KLKB1KLK1
SCHEMBL5757652 0.89 PDE10A (0.48) PDE10ACNR2CNR1PDPK1MET
SCHEMBL5757562 0.89 CNR1 (0.49) PDE10ACNR2CNR1METAP2KLKB1
SCHEMBL5756906 0.88 CNR2 (0.43) CNR2CNR1KLKB1KLK1ELANE
SCHEMBL5757494 0.88 CNR2 (0.42) CNR2CNR1KLKB1KLK1DRD2
SCHEMBL27624389 0.88 CNR2 (0.42) PDE10ACNR2CNR1KLKB1KLK1
SCHEMBL5758836 0.87 TP53 (0.48) PDE10ACNR2CNR1KLKB1KLK1
SCHEMBL5756719 0.87 PDE10A (0.52) PDE10ACNR2CNR1

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 2 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

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 PDE10A 2816/4885CNR2 2164/4885CNR1 2232/4885

“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.