SCHEMBL1596691

SCHEMBL1596691

CCCCC[C@H](CNC(=O)OCc1ccccc1)C(=O)NNC(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.52
CTSS P25774 1/20 0.52
SIRT2 Q8IXJ6 10/20 0.49
SIRT1 Q96EB6 7/20 0.49
SIRT3 Q9NTG7 4/20 0.49
CTSK P43235 1/20 0.48
SYK P43405 1/20 0.48
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TLR2 O60603 1/20 0.47

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
SCHEMBL130760 0.91 MEN1 (0.51) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL133032 0.89 SIRT2 (0.53) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL3902571 0.89 SIRT2 (0.53) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL13434967 0.89 SIRT2 (0.53) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL8054994 0.88 SIRT2 (0.55) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL3319289 0.85 CTSL (0.56) CTSLCTSSSIRT2SIRT1CTSK
SCHEMBL1734009 0.85 CTSL (0.56) CTSLCTSSSIRT2SIRT1CTSK
SCHEMBL4582168 0.84 ANPEP (0.55) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL4542544 0.83 SMN1; SMN2 (0.54) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL6024164 0.81 SYK (0.49) CTSLCTSSSIRT2SIRT1SIRT3

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-7919528-B2 Antibiotic; bactericides GLAXOSMITHKLINE LLC (US) 2011-04-05 US disclosed
EP-1509218-A4 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2008-03-26 EP disclosed
US-20050222412-A1 Peptide deformylase inhibitors GLAXOSMITHKLINE LLC 2005-10-06 US disclosed
EP-1509218-A1 PEPTIDE DEFORMYLASE INHIBITORS SmithKline Beecham Corporation (US) 2005-03-02 EP disclosed
WO-2003101442-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-12-11 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-20050222412-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 CTSL 108/4885CTSS 776/4885SIRT2 2513/4885

“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.