SCHEMBL13722720

SCHEMBL13722720

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

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSS P25774 9/20 0.44
CTSK P43235 8/20 0.44
CTSL P07711 2/20 0.41
CTSB P07858 2/20 0.41
PPARA Q07869 6/20 0.39
PPARG P37231 5/20 0.39
ACE P12821 1/20 0.39
PPARD Q03181 2/20 0.38
GRN P28799 1/20 0.37
SORT1 Q99523 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 0.92 CTSS (0.47) CTSSCTSKCTSLCTSBPPARA
SCHEMBL3818351 0.89 CTSS (0.50) CTSSCTSKCTSLCTSBPPARA
SCHEMBL3822699 0.89 CTSS (0.50) CTSSCTSKCTSLCTSBPPARA
SCHEMBL16313976 0.89 CTSS (0.50) CTSSCTSKCTSLCTSBPPARA
SCHEMBL13723330 0.88 CTSK (0.40) CTSSCTSKCTSLCTSB
SCHEMBL2367381 0.85 CTSK (0.48) CTSSCTSKCTSLCTSBPPARA
SCHEMBL903742 0.85 CTSK (0.48) CTSSCTSKCTSLCTSBPPARA
SCHEMBL2367189 0.85 CTSK (0.48) CTSSCTSKCTSLCTSBPPARA
SCHEMBL66302 0.85 CTSK (0.51) CTSSCTSKCTSLCTSBPPARA
SCHEMBL66303 0.85 CTSK (0.51) CTSSCTSKCTSLCTSBPPARA

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 6 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-8076285-B2 Lysobactin amides AICURIS GMBH & CO. KG (DE) 2011-12-13 US disclosed
EP-2007794-B1 LYSOBACTIN AMIDES AICURIS GMBH & CO KG (DE) 2011-09-14 EP disclosed
US-20090203582-A1 LYSOBACTIN AMIDES BAYER HEALTHCARE AG (DE) 2009-08-13 US disclosed
US-20090203582-A1 LYSOBACTIN AMIDES BAYER HEALTHCARE AG (DE) 2009-08-13 US 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.