SCHEMBL20724701

SCHEMBL20724701

C[C@@H](O)C(O)[C@@H]1O[C@@H]2OC(CO)[C@@H](O[C@H]3OC(CO)[C@@H](O[C@@H]4OC(CO)[C@@H](O[C@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@@H](O[C@@H]7CC(O)[C@H](O[C@@H]8CC(O)[C@H](OO[C@@]9(C)C1[C@H]9n1cc(COc9c(I)cc(Oc%10c(I)cc(CC(=O)O)cc%10I)cc9I)nn1)C(CO)O8)C(CO)O7)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 1/20 0.33
▸ ITGAV P06756 1/20 0.33

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
SCHEMBL20910141 0.81 ITGB3 (0.43) ITGB3ITGAV
SCHEMBL20724700 0.79 ITGB3 (0.37) ITGB3ITGAV
SCHEMBL19677586 0.68 ITGB3 (0.41) ITGB3ITGAV
SCHEMBL19708683 0.62 THRB (0.57) ITGB3ITGAV
SCHEMBL19677575 0.60 ITGB3 (0.61) ITGB3ITGAV
SCHEMBL19708684 0.60 ITGB3 (0.55) ITGB3ITGAV
SCHEMBL19679617 0.60 ALDH1A1 (0.39) —
SCHEMBL19677577 0.58 THRB (0.35) ITGB3ITGAV
SCHEMBL24063119 0.57 THRB (0.47) ITGB3ITGAV
SCHEMBL19677582 0.57 THRB (0.34) ITGB3ITGAV

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-10201616-B2 Non-cleavable polymer conjugated with αVβ3 integrin thyroid antagonists NANOPHARMACEUTICALS, LLC (US) 2019-02-12 — — 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-10201616-B2 Non-cleavable polymer conjugated with αVβ3 integrin thyroid antagonists CD44, THRA, TSHR ITGB3 4/4885ITGAV 12/4885

“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.

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