SCHEMBL13076813

SCHEMBL13076813

CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.64
▸ IL23R Q5VWK5 11/20 0.56
▸ NPY4R P50391 7/20 0.52
▸ NPY1R P25929 6/20 0.52
▸ NPY2R P49146 6/20 0.52
▸ NPY5R Q15761 6/20 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
SCHEMBL12589782 1.00 TFPI (0.64) TFPIIL23RNPY4RNPY1RNPY2R
SCHEMBL12589785 1.00 TFPI (0.64) TFPIIL23RNPY4RNPY1RNPY2R
SCHEMBL16348162 0.92 TFPI (0.60) TFPIIL23RNPY4RNPY1RNPY2R
SCHEMBL13076893 0.89 TFPI (0.57) TFPIIL23RNPY4RNPY1RNPY2R
SCHEMBL30211355 0.89 NPY4R (0.52) TFPIIL23RNPY4RNPY1RNPY2R
SCHEMBL30569208 0.88 TFPI (0.59) TFPIIL23RNPY4RNPY1RNPY2R
SCHEMBL9523164 0.87 TFPI (0.54) TFPIIL23RNPY4RNPY1RNPY2R
SCHEMBL5049208 0.86 NPY4R (0.59) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL30842196 0.85 OPRM1 (0.64) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL29502186 0.85 NPY4R (0.52) TFPINPY4RNPY1RNPY2RNPY5R

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-8524783-B2 Polymer micelles containing anthracylines for the treatment of cancer INTEZYNE TECHNOLOGIES, INCORPORATED (US) 2013-09-03 — — US disclosed
US-20100278928-A1 POLYMER MICELLES CONTAINING ANTHRACYLINES FOR THE TREATMENT OF CANCER INTEZYNE TECHNOLOGIES, INCORPORATED (US) 2010-11-04 — — 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-20100278928-A1 POLYMER MICELLES CONTAINING ANTHRACYLINES FOR THE TREATMENT OF CANCER ABCB4, TOP2A, ANXA5 TFPI 4758/4885IL23R 3056/4885NPY4R 3188/4885

“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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