SCHEMBL1604233

SCHEMBL1604233

Cc1c(I)cc(C(=O)NCCCN(C)C)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.49
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ELANE P08246 6/20 0.47
GAA P10253 1/20 0.44
NOTUM Q6P988 1/20 0.43
TRPV4 Q9HBA0 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
HTR2A P28223 2/20 0.41
HTR2C P28335 2/20 0.41
SLC6A4 P31645 2/20 0.41
CTSK P43235 1/20 0.41
HTT P42858 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
TP53BP1 Q12888 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
SCHEMBL8053624 0.90 ELANE (0.49) KDM4EALDH1A1SMN1; SMN2ELANEGAA
SCHEMBL8228763 0.83 ELANE (0.47) KDM4EALDH1A1SMN1; SMN2ELANEGAA
SCHEMBL2272178 0.83 ELANE (0.56) KDM4EALDH1A1SMN1; SMN2ELANENOTUM
SCHEMBL4152986 0.82 ELANE (0.50) ELANENOTUM
SCHEMBL8065761 0.81 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2ELANEGAA
SCHEMBL4137643 0.81 PDE4B (0.50) SMN1; SMN2ELANENOTUM
SCHEMBL984085 0.79 NOTUM (0.64) ELANENOTUM
SCHEMBL8234302 0.79 ALDH1A1 (0.48) KDM4EALDH1A1SMN1; SMN2ELANEGAA
SCHEMBL8228754 0.79 KDM4E (0.48) KDM4EALDH1A1SMN1; SMN2ELANEGAA
SCHEMBL8229059 0.79 NOTUM (0.51) KDM4EELANEGAANOTUM

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436024-B2 2-pyridone compounds ASTRAZENECA AB (GB) 2013-05-07 US disclosed
US-8436024-B2 2-pyridone compounds ASTRAZENECA AB (GB) 2013-05-07 US disclosed
US-8436024-B2 2-pyridone compounds ASTRAZENECA AB (GB) 2013-05-07 US disclosed
EP-2483244-A1 2-PYRIDONE COMPOUNDS USED AS INHIBITORS OF NEUTROPHIL ELASTASE AstraZeneca AB (SE) 2012-08-08 EP disclosed
WO-2011039528-A1 2-PYRIDONE COMPOUNDS USED AS INHIBITORS OF NEUTROPHIL ELASTASE ASTRAZENECA AB (SE) 2011-04-07 WO disclosed
WO-2011039528-A1 2-PYRIDONE COMPOUNDS USED AS INHIBITORS OF NEUTROPHIL ELASTASE ASTRAZENECA AB (SE) 2011-04-07 WO disclosed
US-20110082155-A1 Novel 2-Pyridone Compounds ASTRAZENECA AB (SE) 2011-04-07 US disclosed
US-20110082155-A1 Novel 2-Pyridone Compounds ASTRAZENECA AB (SE) 2011-04-07 US disclosed
US-20110082155-A1 Novel 2-Pyridone Compounds ASTRAZENECA AB (SE) 2011-04-07 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-20110082155-A1 Novel 2-Pyridone Compounds SERPINB1, ELANE, EPX KDM4E 1513/4885ALDH1A1 1872/4885SMN1; SMN2 1404/4885

“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.