SCHEMBL7145073

SCHEMBL7145073

CC(C)(C)OC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 9/20 0.48
SYK P43405 1/20 0.48
CTSS P25774 4/20 0.47
CTSL P07711 3/20 0.47
CTSB P07858 2/20 0.47
KLK7 P49862 1/20 0.47
KLK5 Q9Y337 1/20 0.47
MMP8 P22894 1/20 0.47
SIRT5 Q9NXA8 1/20 0.45
CASP1 P29466 2/20 0.45
CASP3 P42574 1/20 0.45
CASP7 P55210 1/20 0.45
CASP9 P55211 1/20 0.45
CASP6 P55212 1/20 0.45
CASP8 Q14790 1/20 0.45

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
SCHEMBL7145080 1.00 CTSK (0.48) CTSKSYKCTSSCTSLCTSB
SCHEMBL19359501 0.92 KLK7 (0.56) CTSKSYKCTSSCTSLCTSB
SCHEMBL19359503 0.92 KLK7 (0.56) CTSKSYKCTSSCTSLCTSB
SCHEMBL14254901 0.87 SIRT2 (0.55) CTSKSYKCTSSCTSLCTSB
SCHEMBL7396381 0.85 CTSK (0.54) CTSKSYKCTSSCTSLCTSB
SCHEMBL29743124 0.84 KLK5 (0.54) CTSKSYKCTSSCTSLCTSB
SCHEMBL19370941 0.84 KLK5 (0.54) CTSKSYKCTSSCTSLCTSB
SCHEMBL14037216 0.84 CTSK (0.53) CTSKSYKCTSSCTSLCTSB
SCHEMBL17756116 0.84 CTSK (0.53) CTSKSYKCTSSCTSLCTSB
SCHEMBL478289 0.83 PPARA (0.57) CTSKSYKCTSSCTSLCTSB

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
EP-0928790-B1 Thiazole derivatives HOFFMANN LA ROCHE (CH) 2003-03-05 EP disclosed
US-6344562-B1 ANTITUMOR AGENTS HOFFMANN-LA ROCHE INC. 2002-02-05 US disclosed
US-20020010316-A1 Thiazole derivatives ALIG LEO (CH) 2002-01-24 US disclosed
US-6320054-B1 INHIBIT BINDING OF ADHESIVE PROTEINS TO THE SURFACE OF DIFFERENT TYPES F CELL AND ACCORDINGLY INFLUENCE CELL-CELL AND CELL-MATRIX INTERACTIONS. HOFFMAN-LA ROCHE INC. 2001-11-20 US disclosed
US-6100282-A Thiazole derivatives HOFFMAN-LA ROCHE INC. (US) 2000-08-08 US disclosed
EP-0928790-A1 Thiazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-07-14 EP 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-20020010316-A1 Thiazole derivatives VCAM1, SOST, TGFB1 CTSK 2742/4885SYK 365/4885CTSS 2952/4885

“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.