SCHEMBL13807691

SCHEMBL13807691

CC(C)CCC(NC(=O)C(C)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(NC(=O)C(CCCNC(=N)N)NC(=O)C1CCCN1C(=O)C(N)CCCNC(=N)N)C(C)C)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 2/20 0.57
▸ NTSR2 O95665 4/20 0.56
▸ NTSR1 P30989 4/20 0.56
▸ SORT1 Q99523 4/20 0.56
▸ NPY4R P50391 5/20 0.54
▸ NPY5R Q15761 5/20 0.54
▸ NPY1R P25929 4/20 0.54
▸ NPY2R P49146 2/20 0.54
▸ OPRM1 P35372 6/20 0.53
▸ OPRK1 P41145 6/20 0.53

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
SCHEMBL14524262 0.96 EPHA2 (0.59) EPHA2NTSR2NTSR1SORT1NPY4R
SCHEMBL13807693 0.95 NTSR2 (0.56) EPHA2NTSR2NTSR1SORT1NPY4R
SCHEMBL13807701 0.92 EPHA2 (0.57) EPHA2NTSR2NTSR1NPY4RNPY5R
SCHEMBL31257023 0.90 EPHA2 (0.57) EPHA2NTSR2NTSR1SORT1
SCHEMBL13816930 0.89 NPY4R (0.60) NTSR2NTSR1SORT1NPY4RNPY5R
SCHEMBL9807256 0.88 EPHA2 (0.59) EPHA2NTSR2NTSR1SORT1
SCHEMBL30038002 0.88 NPY4R (0.59) NPY4RNPY5RNPY1RNPY2ROPRM1
SCHEMBL30454832 0.87 EPHA2 (0.57) EPHA2NTSR2NTSR1SORT1
SCHEMBL31410846 0.86 EPHA2 (0.58) EPHA2NTSR2NTSR1SORT1OPRM1
SCHEMBL9807245 0.86 EPHA2 (0.61) EPHA2NTSR2NTSR1SORT1

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-20090156507-A1 Cell permeable conjugates of peptides for inhibition of protein kinases CUREGENICS LTD. 2009-06-18 — — US disclosed
US-20070078092-A1 Cell permeable conjugates of peptides for inhibition of protein kinases CUREGENICS LTD. (IL) 2007-04-05 — — 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-20070078092-A1 Cell permeable conjugates of peptides for inhibition of protein kinases MAP3K20, MAP3K19, MAP4K2 EPHA2 557/4885NTSR2 1235/4885NTSR1 1169/4885
US-20090156507-A1 Cell permeable conjugates of peptides for inhibition of protein kinases MAP3K20, MAP3K19, MAP4K2 EPHA2 557/4885NTSR2 1235/4885NTSR1 1169/4885

“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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