SCHEMBL6474480

SCHEMBL6474480

COC(=O)COc1ccc2c(c1)CCN(CC(NC(=O)OCc1ccccc1)C(=O)OC(C)(C)C)C2=O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 9/20 0.46
ITGB3 P05106 8/20 0.44
ITGA2B P08514 8/20 0.44
CASP1 P29466 3/20 0.42

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
SCHEMBL6483573 0.93 ITGB3 (0.51) AOC3ITGB3ITGA2BCASP1
SCHEMBL6474369 0.91 AOC3 (0.49) AOC3ITGB3ITGA2BCASP1
SCHEMBL6474697 0.88 ITGB3 (0.46) AOC3ITGB3ITGA2BCASP1
SCHEMBL6481213 0.87 CASP1 (0.45) CASP1
SCHEMBL6474852 0.86 ITGB3 (0.55) AOC3ITGB3ITGA2BCASP1
SCHEMBL6474739 0.83 ITGB3 (0.56) AOC3ITGB3ITGA2BCASP1
SCHEMBL15372503 0.81 ITGB3 (0.49) AOC3ITGB3ITGA2BCASP1
SCHEMBL15372554 0.80 CASP1 (0.47) CASP1
SCHEMBL6476116 0.79 ITGB3 (0.55) AOC3ITGB3ITGA2B
SCHEMBL6481405 0.79 ITGB3 (0.49) AOC3ITGB3ITGA2BCASP1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0854140-B1 Vitronectin receptor antagonists, their production and their use SANOFI AVENTIS DEUTSCHLAND (DE) 2013-11-06 EP disclosed
US-6867208-B2 Vitronectin receptor antagonists, their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 2005-03-15 US disclosed
US-20030027807-A1 Vitronectin receptor antagonists, their preparation and their use GENENTECH, INC. AND HOECHST AKTIENGESELLSCHAFT 2003-02-06 US disclosed
US-6387895-B1 BONE DISORDERS; CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 2002-05-14 US disclosed
US-6207663-B1 AS INHIBITORS OF BONE RESORPTION, TUMOR GROWTH, TUMOR METASTASIS, OR INFLAMMATION, OR FOR THE TREATMENT OR PROPHYLAXIS OF CARDIOVASCULAR DISORDERS, NEPHROPATHIES OR RETINOPATHIES HOECHST ATKIENGESELLSCHAFT (DE) 2001-03-27 US disclosed
US-6011045-A Vitronectin receptor antagonists, their preparation and their use HOECHST AKTIENGESELLSCHAFT 2000-01-04 US disclosed
EP-0854140-A2 Vitronectin receptor antagonists, their production and their use HOECHST AKTIENGESELLSCHAFT (DE) 1998-07-22 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-20030027807-A1 Vitronectin receptor antagonists, their preparation and their use ADGRF1, ADGRE5, BSG AOC3 3334/4885ITGB3 173/4885ITGA2B 100/4885

“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.