SCHEMBL12293283

SCHEMBL12293283

C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](CO)C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.52
REN P00797 4/20 0.51
CTSS P25774 4/20 0.50
PPARA Q07869 2/20 0.50
SYK P43405 1/20 0.50
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
PSMB5 P28074 1/20 0.47
ATM Q13315 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.46
KLK5 Q9Y337 1/20 0.46
PPARG P37231 1/20 0.46

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
SCHEMBL16462611 0.91 CTSS (0.57) CTSKRENCTSSCTSLCTSB
SCHEMBL16462608 0.91 CTSS (0.57) CTSKRENCTSSCTSLCTSB
SCHEMBL12292883 0.91 PPARA (0.55) CTSKRENCTSSPPARASYK
SCHEMBL1562695 0.90 PPARA (0.59) CTSKCTSSPPARASYKCTSL
SCHEMBL7172323 0.90 PPARA (0.59) CTSKCTSSPPARASYKCTSL
SCHEMBL1561964 0.90 PPARA (0.59) CTSKCTSSPPARASYKCTSL
SCHEMBL30253476 0.90 PPARA (0.59) CTSKCTSSPPARASYKCTSL
SCHEMBL13723463 0.90 REN (0.48) CTSKRENCTSSPPARASYK
SCHEMBL11761731 0.90 CTSK (0.62) CTSKRENCTSSCTSLCTSB
SCHEMBL11761725 0.90 CTSK (0.62) CTSKRENCTSSCTSLCTSB

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 CTSK 1058/4885REN 1728/4885CTSS 660/4885

“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.