SCHEMBL17518879

SCHEMBL17518879

COCCOCCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(N)=O)[C@@H](C)CP(=O)(O)O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 10/20 0.60
▸ REN P00797 7/20 0.51
▸ PLK3 Q9H4B4 3/20 0.50
▸ PLK2 Q9NYY3 3/20 0.50
▸ RAMP3 O60896 1/20 0.46
▸ CALCR P30988 1/20 0.46
▸ CTSD P07339 1/20 0.45

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
SCHEMBL13470572 1.00 PLK1 (0.60) PLK1RENPLK3PLK2RAMP3
SCHEMBL15729140 1.00 PLK1 (0.60) PLK1RENPLK3PLK2RAMP3
SCHEMBL15729376 0.96 PLK1 (0.61) PLK1RENPLK3PLK2RAMP3
SCHEMBL15729407 0.95 PLK1 (0.55) PLK1RENPLK3PLK2RAMP3
SCHEMBL17518878 0.95 PLK1 (0.55) PLK1RENPLK3PLK2RAMP3
SCHEMBL17518828 0.95 PLK1 (0.55) PLK1RENPLK3PLK2RAMP3
SCHEMBL16118966 0.94 PLK1 (0.58) PLK1RENPLK3PLK2RAMP3
SCHEMBL15729189 0.93 PLK1 (0.69) PLK1RENPLK3PLK2
SCHEMBL20920239 0.93 PLK1 (0.62) PLK1RENPLK3PLK2CTSD
SCHEMBL15729193 0.92 PLK1 (0.64) PLK1RENPLK3PLK2

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-20160039872-A1 PEPTIDE AND PEPTIDE MIMETIC BINDING ANTAGONISTS OF POLO-LIKE KINASE 1 POLO BOX DOMAIN AND METHODS OF USE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH & HUMAN SERVICES 2016-02-11 — — 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-20160039872-A1 PEPTIDE AND PEPTIDE MIMETIC BINDING ANTAGONISTS OF POLO-LIKE KINASE 1 POLO BOX DOMAIN AND METHODS OF USE PLK1, PHKG1, ACP1 PLK1 1/4885REN 4454/4885PLK3 131/4885

“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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