SCHEMBL13166793

SCHEMBL13166793

CC(=N)NCCC[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)CNC1=O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 20/20 0.52
▸ ITGAV P06756 16/20 0.52
▸ ITGA5 P08648 4/20 0.52
▸ ITGB1 P05556 2/20 0.52
▸ ITGA2B P08514 4/20 0.52
▸ ITGB5 P18084 9/20 0.52

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
SCHEMBL18968795 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL13107808 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL16946584 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL19605481 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL7743533 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL12808284 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL7743878 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL14885799 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL21475019 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL12547669 0.92 ITGB3 (0.55) ITGB3ITGAVITGA5ITGB1ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367065-B2 Targeted polymeric prodrugs containing multifunctional linkers ENZON PHARMACEUTICALS, INC. (US) 2013-02-05 — — US disclosed
US-20100233190-A1 TARGETED POLYMERIC PRODRUGS CONTAINING MULTIFUNCTIONAL LINKERS ENZON PHARMACEUTICALS, INC. (US) 2010-09-16 — — US disclosed
US-20090202573-A1 POLYMERIC CONJUGATES CONTAINING POSITIVELY-CHARGED MOIETIES ENZON PHARMACEUTICALS, INC. (US) 2009-08-13 — — 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 (2 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-20100233190-A1 TARGETED POLYMERIC PRODRUGS CONTAINING MULTIFUNCTIONAL LINKERS PAICS, FCGRT, DNPEP ITGB3 565/4885ITGAV 398/4885ITGA5 421/4885
US-20090202573-A1 POLYMERIC CONJUGATES CONTAINING POSITIVELY-CHARGED MOIETIES PIGO, PHOSPHO1, PAICS ITGB3 219/4885ITGAV 192/4885ITGA5 291/4885

“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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