SCHEMBL6168769

SCHEMBL6168769

COC(=O)C(C)CC(NC(=O)OC(C)(C)C)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 7/20 0.48
▸ CTSS P25774 5/20 0.48
▸ CTSL P07711 2/20 0.48
▸ CTSB P07858 1/20 0.48
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ NFKB1 P19838 1/20 0.44
▸ NFKB2 Q00653 1/20 0.44
▸ RELA Q04206 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ CAPN1 P07384 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ PSEN1 P49768 2/20 0.41
▸ PSEN2 P49810 2/20 0.41

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
SCHEMBL19000135 1.00 CTSK (0.48) CTSKCTSSCTSLCTSBCA1
SCHEMBL13621256 1.00 CTSK (0.48) CTSKCTSSCTSLCTSBCA1
SCHEMBL6168773 1.00 CTSK (0.48) CTSKCTSSCTSLCTSBCA1
SCHEMBL1318454 1.00 CTSK (0.48) CTSKCTSSCTSLCTSBCA1
SCHEMBL30174879 0.90 CTSK (0.49) CTSKCTSSCTSLCTSBCA1
SCHEMBL13293190 0.90 CTSK (0.49) CTSKCTSSCTSLCTSBCA1
SCHEMBL12146644 0.90 CTSK (0.46) CTSKCTSSCTSLCTSBCA1
SCHEMBL12673233 0.88 CTSK (0.49) CTSKCTSSCTSLCTSBCA1
SCHEMBL55832 0.88 CTSL (0.60) CTSKCTSSCTSLCTSBCA1
SCHEMBL56907 0.88 CTSL (0.60) CTSKCTSSCTSLCTSBCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9375497-B2 [F-18]-labeled L-glutamic acid, [F-18]-labeled L-glutamine, derivatives thereof and use thereof and processes for their preparation PIRAMAL IMAGING SA (CH) 2016-06-28 — — US disclosed
US-20140301948-A1 [F-18]-LABELED L-GLUTAMIC ACID, [F-18]-LABELED L-GLUTAMINE, DERIVATIVES THEREOF AND USE THEREOF AND PROCESSES FOR THEIR PREPARATION BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2014-10-09 — — US disclosed
EP-2123619-A1 New [F-18]-marked L-glutamic acids and L-glutamic acid derivatives (II), application thereof and method for their manufacture Bayer Schering Pharma AG (DE) 2009-11-25 — — EP disclosed
US-6900224-B2 Antimicrobial quinolones, their compositions and uses THE PROCTER & GAMBLE COMPANY (US) 2005-05-31 — — US disclosed
EP-1532137-A2 ANTIMICROBIAL AZA-BICYCLIC DERIVATES, THEIR COMPOSITIONS AND USES THE PROCTER & GAMBLE COMPANY (US) 2005-05-25 — — EP disclosed
US-20040038975-A1 Antimicrobial quinolones, their compositions and uses THE PROCTER & GAMBLE COMPANY 2004-02-26 — — US disclosed
WO-2004014893-A2 ANTIMICROBIAL AZA-BICYCLIC DERIVATES, THEIR COMPOSITIONS AND USES THE PROCTER & GAMBLE COMPANY (US) 2004-02-19 — — 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-20140301948-A1 [F-18]-LABELED L-GLUTAMIC ACID, [F-18]-LABELED L-GLUTAMINE, DERIVATIVES THEREOF AND USE THEREOF AND PROCESSES FOR THEIR PREPARATION GLUL, GFPT1, QPCT CTSK 2486/4885CTSS 3451/4885CTSL 2203/4885
US-20040038975-A1 Antimicrobial quinolones, their compositions and uses QARS1, NQO2, Q6ZSR9 CTSK 1032/4885CTSS 1129/4885CTSL 852/4885

“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.

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