SCHEMBL2367415

SCHEMBL2367415

C[C@H](O)[C@H](NC(=O)CN)C(=O)N[C@@H](COC(=O)C(F)(F)F)C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.44
CTSL P07711 4/20 0.44
PSMB8 P28062 1/20 0.42
PSMB9 P28065 1/20 0.42
PSMB5 P28074 1/20 0.42
CTSK P43235 7/20 0.40
ELANE P08246 5/20 0.40
IL1RN P18510 1/20 0.39
ERAP2 Q6P179 1/20 0.39
ERAP1 Q9NZ08 1/20 0.39
CTRC Q99895 2/20 0.38

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
SCHEMBL2367398 1.00 CTSS (0.44) CTSSCTSLPSMB8PSMB9PSMB5
SCHEMBL2367824 0.89 CTSK (0.43) CTSSCTSLPSMB8PSMB9PSMB5
Trifluoroacetic Acid SCHEMBL27766395 0.87 CTSL (0.45) CTSSCTSLPSMB8PSMB9PSMB5
SCHEMBL2367014 0.85 QRFPR (0.40) CTSSCTSLPSMB5CTSKIL1RN
SCHEMBL2367341 0.85 ACE (0.45) CTSSCTSLCTSK
SCHEMBL2367418 0.85 CTSS (0.44) CTSSCTSLCTSKIL1RNERAP2
SCHEMBL2367197 0.85 CTSS (0.44) CTSSCTSLCTSKIL1RNERAP2
SCHEMBL13724068 0.84 CTSL (0.50) CTSSCTSLPSMB8PSMB9PSMB5
SCHEMBL13723094 0.84 CTSL (0.50) CTSSCTSLPSMB8PSMB9PSMB5
SCHEMBL2367498 0.83 CTSS (0.46) CTSSCTSLCTSKIL1RNERAP2

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
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
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 660/4885CTSL 196/4885PSMB8 2618/4885

“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.