SCHEMBL5758917

SCHEMBL5758917

CCCCn1cc(C(=O)NCc2ccncc2)c(=O)n(-c2cccc(C(F)(F)F)c2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.50
SORT1 Q99523 1/20 0.47
PDE4A P27815 4/20 0.47
PDE4B Q07343 4/20 0.47
PDE4C Q08493 4/20 0.47
PDE4D Q08499 4/20 0.47
CNR2 P34972 3/20 0.45
CNR1 P21554 1/20 0.45
DDT P30046 1/20 0.44
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
FLT1 P17948 3/20 0.43
KDR P35968 3/20 0.43

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
SCHEMBL5759044 0.90 ELANE (0.55) ELANECNR2CNR1DDT
SCHEMBL5757228 0.90 ELANE (0.53) ELANECNR2CNR1DDTLMNA
SCHEMBL5755543 0.90 ELANE (0.52) ELANECNR2CNR1DDT
SCHEMBL5757834 0.90 ELANE (0.51) ELANESORT1PDE4APDE4BPDE4C
SCHEMBL5758531 0.90 ELANE (0.52) ELANECNR2CNR1LMNAHPGD
SCHEMBL5758706 0.89 ELANE (0.49) ELANECNR2CNR1DDT
SCHEMBL5757653 0.89 CNR2 (0.47) ELANECNR2CNR1KDM4EUSP2
SCHEMBL5757760 0.88 RECQL (0.52) ELANEALDH1A1LMNAMAPT
SCHEMBL27624355 0.88 ELANE (0.51) ELANECNR2CNR1DDT
SCHEMBL5757122 0.87 ELANE (0.68) ELANE

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 2/4885SORT1 3087/4885PDE4A 647/4885

“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.