SCHEMBL6789457

SCHEMBL6789457

CC1c2cc(OCCCNc3ccccn3)ccc2CC(CC(=O)O)C(=O)N1C

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.73
ITGAV P06756 20/20 0.73
ITGA2B P08514 8/20 0.73
ITGB5 P18084 6/20 0.64
ITGB1 P05556 4/20 0.64
ITGB6 P18564 2/20 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
SCHEMBL2043373 0.88 ITGB3 (0.73) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL6787868 0.85 ITGB3 (0.66) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL328727 0.85 ITGB3 (1.00) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL6422439 0.84 ITGB3 (0.52) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL12010935 0.82 ITGB3 (0.81) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL6419346 0.81 ITGB3 (0.82) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL6418095 0.80 ITGB3 (0.78) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL6418086 0.80 ITGB3 (0.78) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL21291259 0.80 ITGB3 (0.77) ITGB3ITGAVITGA2BITGB5ITGB1
SCHEMBL6422315 0.79 ITGB3 (0.80) ITGB3ITGAVITGA2BITGB5ITGB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6825188-B2 MORE POTENT INHIBITORS OF THE VITRONECTIN RECEPTOR THAN THE FIBRINOGEN SMITHKLINE BEECHAM CORPORATION 2004-11-30 US disclosed
US-20040082559-A1 Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2004-04-29 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-20040082559-A1 Vitronectin receptor antagonists VCAM1, GPR174, ADGRF1 ITGB3 131/4885ITGAV 302/4885ITGA2B 191/4885

“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.