SCHEMBL10208596

SCHEMBL10208596

O=C(O)c1cn(C2CCCC2)cc(O)c1=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ACMSD Q8TDX5 2/20 0.39
HSD17B10 Q99714 3/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 2/20 0.36
HPGD P15428 1/20 0.36
GSK3B P49841 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TOP2A P11388 1/20 0.34
TOP2B Q02880 1/20 0.34
STAT3 P40763 1/20 0.33
LMNA P02545 1/20 0.33
NOTUM Q6P988 1/20 0.33
HTT P42858 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL10208794 0.81 KDM4E (0.41) KDM4EACMSDALDH1A1HPGDMEN1
SCHEMBL10208793 0.81 KDM4E (0.41) KDM4EACMSDALDH1A1HPGDMEN1
SCHEMBL10208671 0.80 KDM4E (0.37) KDM4EACMSDTOP2ATOP2BSTAT3
SCHEMBL10208762 0.78 KDM4E (0.40) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL10209063 0.75 SLC18A3 (0.40) KDM4EACMSDHSD17B10ALDH1A1HPGD
SCHEMBL23147836 0.75 MET (0.42) KDM4ETOP2ATOP2B
SCHEMBL10208651 0.73 PSEN1 (0.41) KDM4EALDH1A1MEN1KMT2ALMNA
SCHEMBL10208643 0.73 PSEN1 (0.41) KDM4EALDH1A1MEN1KMT2ALMNA
SCHEMBL23147452 0.72 MET (0.42) KDM4ETOP2ATOP2BLMNA
SCHEMBL10208397 0.72 KDM4C (0.40) KDM4EACMSDNOTUM

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
US-8835461-B2 Substituted 3-hydroxy-4-pyridone derivative SHIONOGI & CO., LTD. (JP) 2014-09-16 US disclosed
US-8835461-B2 Substituted 3-hydroxy-4-pyridone derivative SHIONOGI & CO., LTD. (JP) 2014-09-16 US disclosed
EP-2412708-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE Shionogi&Co., Ltd. (JP) 2012-02-01 EP disclosed
US-20120022255-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2012-01-26 US disclosed
US-20120022255-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2012-01-26 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-20120022255-A1 SUBSTITUTED 3-HYDROXY-4-PYRIDONE DERIVATIVE ENDOD1, CNBP, DPP4 KDM4E 195/4885ACMSD 4150/4885HSD17B10 856/4885

“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.