SCHEMBL5964588

SCHEMBL5964588

COC(=O)[C@H](CCC(C)=O)NC(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.60
ALOX15 P16050 1/20 0.60
KYNU Q16719 1/20 0.59
SIRT2 Q8IXJ6 1/20 0.57
SIRT1 Q96EB6 1/20 0.57
SIRT3 Q9NTG7 1/20 0.57
CTSK P43235 5/20 0.53
CTSL P07711 4/20 0.52
CTSS P25774 4/20 0.52
CTSB P07858 2/20 0.52
TRPM8 Q7Z2W7 1/20 0.51
TACR1 P25103 2/20 0.50

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
SCHEMBL27646832 1.00 ALDH1A1 (0.60) ALDH1A1ALOX15KYNUSIRT2SIRT1
SCHEMBL10054772 0.94 ALDH1A1 (0.56) ALDH1A1ALOX15KYNUCTSKCTSL
SCHEMBL6259518 0.90 KYNU (0.60) ALDH1A1ALOX15KYNUSIRT2SIRT1
SCHEMBL221391 0.90 KYNU (0.60) ALDH1A1ALOX15KYNUSIRT2SIRT1
SCHEMBL2777678 0.90 KYNU (0.60) ALDH1A1ALOX15KYNUSIRT2SIRT1
SCHEMBL27626645 0.90 FOLH1 (0.57) ALDH1A1ALOX15SIRT2SIRT1CTSK
SCHEMBL116479 0.90 FOLH1 (0.57) ALDH1A1ALOX15SIRT2SIRT1CTSK
SCHEMBL11053442 0.89 KYNU (0.59) ALDH1A1ALOX15KYNUSIRT2SIRT1
SCHEMBL7087075 0.89 KYNU (0.59) ALDH1A1ALOX15KYNUSIRT2SIRT1
SCHEMBL8224981 0.89 KYNU (0.59) ALDH1A1ALOX15KYNUSIRT2SIRT1

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
US-20060229254-A1 Compounds having prolyl oligopeptidase inhibitory activity ORION CORPORATION (FI) 2006-10-12 US disclosed
EP-1581489-A2 COMPOUNDS HAVING PROLYL OLIGOPEPTIDASE INHIBITORY ACTIVITY ORION CORPORATION (FI) 2005-10-05 EP disclosed
WO-2004060862-A2 COMPOUNDS HAVING PROLYL OLIGOPEPTIDASE INHIBITORY ACTIVITY ORION CORPORATION (FI) 2004-07-22 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-20060229254-A1 Compounds having prolyl oligopeptidase inhibitory activity PREP, DNPEP, IDE ALDH1A1 2051/4885ALOX15 2741/4885KYNU 1493/4885

“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.