SCHEMBL4086808

SCHEMBL4086808

CC(C)(C)OC(=O)N[C@H](C[Si](C)(C)C)C(=O)N[C@@](C)(C(=O)O)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSS P25774 16/20 0.44
CTSK P43235 16/20 0.44
CTSL P07711 2/20 0.42
CTSB P07858 2/20 0.42
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37

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
SCHEMBL14190234 0.81 CTSS (0.47) CTSSCTSKCTSLCTSB
SCHEMBL2367381 0.81 CTSK (0.48) CTSSCTSKCTSLCTSBCA1
SCHEMBL2367189 0.81 CTSK (0.48) CTSSCTSKCTSLCTSBCA1
SCHEMBL903742 0.81 CTSK (0.48) CTSSCTSKCTSLCTSBCA1
SCHEMBL5045559 0.77 CTSK (0.43) CTSSCTSKCTSLCTSBCA1
SCHEMBL13722720 0.77 CTSS (0.44) CTSSCTSKCTSLCTSB
SCHEMBL13723330 0.73 CTSK (0.40) CTSSCTSKCTSLCTSBCA1
SCHEMBL30043413 0.73 MEN1 (0.38) CTSSCTSKCTSLCTSBCA1
SCHEMBL3820796 0.70 CTSK (0.39) CTSSCTSKCTSLCTSBCA1
SCHEMBL5517842 0.70 CTSL (0.72) CTSSCTSKCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8076285-B2 Lysobactin amides AICURIS GMBH & CO. KG (DE) 2011-12-13 US disclosed
US-20090203582-A1 LYSOBACTIN AMIDES BAYER HEALTHCARE AG (DE) 2009-08-13 US disclosed
EP-2007794-A1 LYSOBACTIN AMIDES AiCuris GmbH & Co. KG (DE) 2008-12-31 EP disclosed
WO-2007118691-A1 LYSOBACTIN AMIDES AICURIS GMBH & CO. KG (DE) 2007-10-25 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-20090203582-A1 LYSOBACTIN AMIDES AADAT, HAMP, DLST CTSS 660/4885CTSK 1058/4885CTSL 196/4885

“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.