SCHEMBL13807693

SCHEMBL13807693

CC(C)CCC(NC(=O)C(CN)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 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NTSR2 O95665 8/20 0.56
▸ NTSR1 P30989 8/20 0.56
▸ SORT1 Q99523 8/20 0.56
▸ NPY4R P50391 3/20 0.54
▸ NPY1R P25929 2/20 0.54
▸ NPY2R P49146 2/20 0.54
▸ NPY5R Q15761 2/20 0.54
▸ KDM1A O60341 3/20 0.53
▸ MAOB P27338 1/20 0.52
▸ KDM5A P29375 1/20 0.52
▸ KDM1B Q8NB78 1/20 0.52
▸ EPHA2 P29317 1/20 0.52
▸ OPRM1 P35372 1/20 0.52
▸ NPFFR1 Q9GZQ6 1/20 0.52
▸ NPFFR2 Q9Y5X5 1/20 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
SCHEMBL13807691 0.95 EPHA2 (0.57) NTSR2NTSR1SORT1NPY4RNPY1R
SCHEMBL14524262 0.91 EPHA2 (0.59) NTSR2NTSR1SORT1NPY4RNPY1R
SCHEMBL14546467 0.89 NPY4R (0.60) NTSR2NTSR1SORT1NPY4RNPY1R
SCHEMBL9807256 0.88 EPHA2 (0.59) NTSR2NTSR1SORT1KDM1AMAOB
SCHEMBL30038002 0.88 NPY4R (0.59) NPY4RNPY1RNPY2RNPY5ROPRM1
SCHEMBL13807698 0.87 NMUR2 (0.57) NTSR1NPY4RNPY1RNPY2RNPY5R
SCHEMBL13807701 0.87 EPHA2 (0.57) NTSR2NTSR1NPY4RNPY1RNPY2R
SCHEMBL31410846 0.86 EPHA2 (0.58) NTSR2NTSR1SORT1KDM1AEPHA2
SCHEMBL9807245 0.86 EPHA2 (0.61) NTSR2NTSR1SORT1EPHA2
SCHEMBL10592955 0.85 NTSR2 (0.64) NTSR2NTSR1SORT1NPY4RNPY1R

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 NTSR2 1235/4885NTSR1 1169/4885SORT1 1998/4885
US-20090156507-A1 Cell permeable conjugates of peptides for inhibition of protein kinases MAP3K20, MAP3K19, MAP4K2 NTSR2 1235/4885NTSR1 1169/4885SORT1 1998/4885

“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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