SCHEMBL5759549

SCHEMBL5759549

Cc1ccc(C(=O)NCCC2CCOCC2)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.57
BRD4 O60885 1/20 0.44
NOTUM Q6P988 1/20 0.43
CNR2 P34972 1/20 0.42
CHRM4 P08173 2/20 0.42
CCR2 P41597 1/20 0.42
CCR5 P51681 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RORC P51449 1/20 0.41
CHRM2 P08172 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL5758317 0.89 ELANE (0.59) ELANENOTUMKDM4EALDH1A1SMN1; SMN2
SCHEMBL5759735 0.85 ELANE (0.57) ELANESMN1; SMN2KMT2A
SCHEMBL5759586 0.84 ELANE (0.63) ELANENOTUMCNR2KDM4EALDH1A1
SCHEMBL11895127 0.84 BRD4 (0.42) ELANEBRD4NOTUMCNR2CHRM4
SCHEMBL561083 0.84 BRD4 (0.46) ELANEBRD4NOTUMCHRM4CHRM2
SCHEMBL31490322 0.84 BRD4 (0.46) ELANEBRD4NOTUMCHRM4CHRM2
SCHEMBL5757337 0.84 ELANE (0.56) ELANENOTUM
SCHEMBL5437717 0.84 PLA2G10 (0.47) ELANEBRD4CNR2CHRM4KMT2A
SCHEMBL5757609 0.84 ELANE (0.56) ELANEKDM4EALDH1A1SMN1; SMN2KMT2A
SCHEMBL5759188 0.82 ELANE (0.60) ELANENOTUMCNR2CCR2ALDH1A1

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 ELANE 2/4885BRD4 2242/4885NOTUM 3748/4885

“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.