SCHEMBL5758477

SCHEMBL5758477

Cc1ccc(C(=O)N[C@H]2CCc3ccccc32)c(=O)n1-c1cccc(C#N)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.51
LMNA P02545 2/20 0.47
ALDH1A1 P00352 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TAS1R3 Q7RTX0 5/20 0.45
TAS1R1 Q7RTX1 5/20 0.45
TAS1R2 Q8TE23 5/20 0.45
PDE10A Q9Y233 4/20 0.45
PDE2A O00408 1/20 0.44
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
SPR P35270 1/20 0.43
NOTUM Q6P988 1/20 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
SCHEMBL5758228 1.00 RIPK1 (0.51) RIPK1LMNAALDH1A1L3MBTL1TAS1R3
SCHEMBL5758365 0.95 ALDH1A1 (0.55) LMNAALDH1A1L3MBTL1TAS1R3TAS1R1
SCHEMBL5757044 0.83 ELANE (0.53) LMNAALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL5757779 0.78 TAS1R3 (0.53) LMNAALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL5757916 0.78 NOTUM (0.47) RIPK1PDE4BPDE4DNOTUM
SCHEMBL5755397 0.76 NOTUM (0.44) RIPK1PDE10ANOTUM
SCHEMBL5757705 0.75 ELANE (0.55) ALDH1A1NOTUM
SCHEMBL5756499 0.74 CNR1 (0.54) LMNAALDH1A1L3MBTL1NOTUM
SCHEMBL5758147 0.73 HPGD (0.47) LMNAALDH1A1PDE10ANOTUM
SCHEMBL5756352 0.72 DRD2 (0.48)

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 RIPK1 3651/4885LMNA 509/4885ALDH1A1 1465/4885

“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.