SCHEMBL7507825

SCHEMBL7507825

O=C(O)CC(Cc1ccc(OCCc2ccc3c(n2)NCCC3)cc1)c1nccs1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.76
ITGAV P06756 20/20 0.76
ITGB6 P18564 11/20 0.76
ITGB5 P18084 6/20 0.76
ITGA2B P08514 3/20 0.76
ITGB1 P05556 2/20 0.56
ITGA5 P08648 1/20 0.56

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
SCHEMBL7507810 1.00 ITGB3 (0.76) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL7507817 0.87 ITGB3 (0.57) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL6178862 0.86 ITGB3 (1.00) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL6178864 0.86 ITGB3 (1.00) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL1824185 0.83 ITGB3 (0.86) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL1824189 0.83 ITGB3 (0.86) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL1825833 0.81 ITGB3 (0.83) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL1825834 0.81 ITGB3 (0.83) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL4786884 0.80 ITGB3 (0.71) ITGB3ITGAVITGB6ITGB5ITGA2B
SCHEMBL6178889 0.78 ITGB3 (0.74) ITGB3ITGAVITGB6ITGB5ITGA2B

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-20020147334-A1 Vitronectin Receptor Antagonists SMITHKLINE BEECHAM CORPORATION 2002-10-10 US claimed
US-20020147334-A1 Vitronectin Receptor Antagonists SMITHKLINE BEECHAM CORPORATION 2002-10-10 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-20020147334-A1 Vitronectin Receptor Antagonists ADGRF1, FN1, CALCR ITGB3 82/4885ITGAV 146/4885ITGB6 61/4885

“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.