SCHEMBL15569446

SCHEMBL15569446

COCC(NC(=O)C(COC(F)F)NC(=O)OC(C)(C)C)C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.53
PPARA Q07869 3/20 0.50
SYK P43405 1/20 0.47
PPARG P37231 2/20 0.46
CTSK P43235 6/20 0.46
CTSL P07711 2/20 0.46
CTSB P07858 1/20 0.46
KLK7 P49862 2/20 0.45
KLK5 Q9Y337 2/20 0.45
REN P00797 4/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL15569444 1.00 CTSS (0.53) CTSSPPARASYKPPARGCTSK
SCHEMBL16925147 1.00 CTSS (0.53) CTSSPPARASYKPPARGCTSK
SCHEMBL15568625 0.97 CTSS (0.55) CTSSPPARASYKPPARGCTSK
SCHEMBL15568621 0.97 CTSS (0.55) CTSSPPARASYKPPARGCTSK
SCHEMBL16984839 0.97 CTSS (0.55) CTSSPPARASYKPPARGCTSK
SCHEMBL16984877 0.93 CTSS (0.55) CTSSPPARACTSKCTSLCTSB
SCHEMBL15570214 0.93 PPARA (0.57) CTSSPPARASYKPPARGCTSK
SCHEMBL15569220 0.93 PPARA (0.57) CTSSPPARASYKPPARGCTSK
SCHEMBL8138593 0.93 CTSS (0.59) CTSSPPARASYKPPARGCTSK
SCHEMBL16984916 0.92 CTSK (0.56) CTSSCTSKCTSLCTSBREN

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-20160347792-A1 FLUORINATED EPOXYKETONE-BASED COMPOUNDS AND USES THEREOF AS PROTEASOME INHIBITORS TRILLIUM THERAPEUTICS INC. (CA) 2016-12-01 US disclosed
US-9441012-B2 Fluorinated epoxyketone-based compounds and uses thereof as proteasome inhibitors TRILLIUM THERAPEUTICS INC. (CA) 2016-09-13 US disclosed
US-20150203534-A1 FLUORINATED EPOXYKETONE-BASED COMPOUNDS AND USES THEREOF AS PROTEASOME INHIBITORS FLUORINOV PHARMA INC. (CA) 2015-07-23 US disclosed
EP-2885314-A1 FLUORINATED EPOXYKETONE-BASED COMPOUNDS AND USES THEREOF AS PROTEASOME INHIBITORS Fluorinov Pharma Inc. (CA) 2015-06-24 EP disclosed
WO-2014026282-A1 FLUORINATED EPOXYKETONE-BASED COMPOUNDS AND USES THEREOF AS PROTEASOME INHIBITORS SLASSI ABDELMALIK (CA) 2014-02-20 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 (2 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-20160347792-A1 FLUORINATED EPOXYKETONE-BASED COMPOUNDS AND USES THEREOF AS PROTEASOME INHIBITORS PSMB5, PSMB1, PSMB7 CTSS 1116/4885PPARA 2426/4885SYK 3227/4885
US-20150203534-A1 FLUORINATED EPOXYKETONE-BASED COMPOUNDS AND USES THEREOF AS PROTEASOME INHIBITORS PSMB5, PSMB1, PSMB7 CTSS 1197/4885PPARA 2465/4885SYK 3218/4885

“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.