SCHEMBL13722844

SCHEMBL13722844

C[Si](C)(C)CCOC(=O)[C@H](CN)NC(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
CTSK P43235 5/20 0.51
CTSS P25774 5/20 0.51
CTSL P07711 4/20 0.51
CTSB P07858 3/20 0.51
ITGB3 P05106 4/20 0.47
ITGA2B P08514 4/20 0.47
ALDH1A1 P00352 1/20 0.47
ALOX15 P16050 1/20 0.47
KYNU Q16719 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
Trifluoroacetic Acid SCHEMBL4082678 0.94 CTSS (0.49) ATMCTSKCTSSCTSLCTSB
SCHEMBL29466819 0.89 CTSL (0.61) ATMCTSKCTSSCTSLCTSB
SCHEMBL21293823 0.88 TLR2 (0.55) CTSSCTSLITGB3ITGA2B
SCHEMBL21293821 0.88 TLR2 (0.55) CTSSCTSLITGB3ITGA2B
SCHEMBL29365506 0.86 CTSS (0.53) CTSKCTSSCTSLCTSBITGB3
SCHEMBL28682040 0.86 CTSS (0.53) CTSKCTSSCTSLCTSBITGB3
SCHEMBL30437751 0.86 CTSK (0.56) CTSKCTSSCTSLCTSBITGB3
SCHEMBL29521405 0.86 CTSK (0.56) CTSKCTSSCTSLCTSBITGB3
SCHEMBL29017554 0.86 CTSK (0.56) CTSKCTSSCTSLCTSBITGB3
SCHEMBL22975081 0.85 KYNU (0.54) CTSKCTSSCTSLCTSBITGB3

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 3 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
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

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 ATM 4224/4885CTSK 1058/4885CTSS 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.