SCHEMBL7036508

SCHEMBL7036508

CCOC(=O)[C@H](CNC(=O)c1ccc(OCCNc2ncccn2)cc1O)NS(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 17/20 0.46
ITGAV P06756 4/20 0.46
ITGA2B P08514 15/20 0.44
ITGB5 P18084 1/20 0.39
KAT6A Q92794 3/20 0.39

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
Hydrochloric Acid SCHEMBL7032405 0.99 ITGB3 (0.46) ITGB3ITGAVITGA2BITGB5KAT6A
SCHEMBL7037924 0.91 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5
SCHEMBL7037266 0.88 ITGB3 (0.54) ITGB3ITGAVITGA2BITGB5
SCHEMBL7036686 0.84 ITGB3 (0.43) ITGB3ITGAVITGA2B
SCHEMBL7035444 0.84 ITGB3 (0.64) ITGB3ITGAVITGA2B
Hydrochloric Acid SCHEMBL7036683 0.83 ITGB3 (0.43) ITGB3ITGAVITGA2B
Hydrochloric Acid SCHEMBL7030628 0.83 ITGB3 (0.43) ITGB3ITGAVITGA2B
SCHEMBL7032427 0.82 ITGB3 (0.41) ITGB3ITGAVITGA2B
SCHEMBL7032444 0.79 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5
SCHEMBL7038923 0.78 ITGB3 (0.40) ITGB3ITGAVITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2003-10-02 US claimed

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-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors ASGR1, TEK, APLNR ITGB3 403/4885ITGAV 289/4885ITGA2B 573/4885

“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.