SCHEMBL5756864

SCHEMBL5756864

Cc1ccc(C(=O)NCCC2CCCN2C)c(=O)n1-c1cccc(C#N)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.47
POLR1A O95602 1/20 0.44
CHRM3 P20309 2/20 0.43
ACKR3 P25106 3/20 0.42
NOTUM Q6P988 1/20 0.41
EED O75530 1/20 0.41
ELANE P08246 3/20 0.40
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
CHRM4 P08173 2/20 0.38
SLC6A4 P31645 1/20 0.38

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
SCHEMBL5757337 0.85 ELANE (0.56) POLR1ACHRM3ACKR3NOTUMEED
SCHEMBL5756352 0.84 DRD2 (0.48) SLC6A4
SCHEMBL5757916 0.81 NOTUM (0.47) EGLN1NOTUMELANECHRM1
SCHEMBL5755397 0.81 NOTUM (0.44) EGLN1NOTUMELANE
SCHEMBL5756977 0.78 TP53 (0.47) NOTUMELANE
SCHEMBL5756893 0.77 MAPT (0.48)
SCHEMBL27643772 0.77 KLKB1 (0.48) NOTUMELANE
SCHEMBL6219146 0.77 ELANE (0.49) POLR1ACHRM3ACKR3EEDELANE
SCHEMBL5757705 0.77 ELANE (0.55) NOTUMELANE
SCHEMBL5757117 0.76 ELANE (0.47) NOTUMELANE

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 EGLN1 3851/4885POLR1A 743/4885CHRM3 584/4885

“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.