SCHEMBL7142465

SCHEMBL7142465

CCCCS(=O)(=O)N[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 11/20 0.50
ITGA2B P08514 10/20 0.50
MMP2 P08253 5/20 0.47
MMP9 P14780 5/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
ITGAV P06756 2/20 0.41
MMP8 P22894 3/20 0.40
MMP12 P39900 3/20 0.40
MMP14 P50281 3/20 0.40
CA2 P00918 2/20 0.40
NOD1 Q9Y239 1/20 0.40
CA1 P00915 1/20 0.40

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
SCHEMBL7118389 0.88 ITGB3 (0.52) ITGB3ITGA2BMMP2MMP9ITGAV
SCHEMBL7144029 0.84 ITGB3 (0.53) ITGB3ITGA2BMMP2MMP9ITGAV
SCHEMBL7144039 0.84 ITGB3 (0.53) ITGB3ITGA2BMMP2MMP9ITGAV
SCHEMBL7033322 0.84 ITGB3 (0.47) ITGB3ITGA2BITGAVCA2
SCHEMBL7395698 0.83 ITGB3 (0.47) ITGB3ITGA2BMMP2MMP9ITGAV
SCHEMBL6818957 0.83 ITGB3 (0.51) ITGB3ITGA2BITGAVNOD1
SCHEMBL31522342 0.83 ITGB3 (0.51) ITGB3ITGA2BITGAVNOD1
SCHEMBL7262653 0.81 ITGB3 (0.52) ITGB3ITGA2BITGAV
SCHEMBL7262649 0.81 ITGB3 (0.52) ITGB3ITGA2BITGAV
SCHEMBL4059094 0.80 ITGB3 (0.51) ITGB3ITGA2BMMP2MMP9ITGAV

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 ITGB3 7/4885ITGA2B 106/4885MMP2 382/4885

“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.