SCHEMBL13807701

SCHEMBL13807701

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(CCCNC(=N)N)NC(=O)C(N)C(C)CCNC(=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
▸ OPRM1 P35372 6/20 0.53
▸ OPRK1 P41145 6/20 0.53
▸ KDM1A O60341 2/20 0.52
▸ NPY2R P49146 7/20 0.51
▸ NPY4R P50391 7/20 0.51
▸ NPY5R Q15761 7/20 0.51
▸ NPY1R P25929 5/20 0.51
▸ NTSR2 O95665 1/20 0.51
▸ NTSR1 P30989 1/20 0.51

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 0.93 EPHA2 (0.59) EPHA2OPRM1OPRK1KDM1ANPY2R
SCHEMBL13807691 0.92 EPHA2 (0.57) EPHA2OPRM1OPRK1NPY2RNPY4R
SCHEMBL13807693 0.87 NTSR2 (0.56) EPHA2OPRM1KDM1ANPY2RNPY4R
SCHEMBL9807268 0.83 KDM1A (0.57) EPHA2OPRM1OPRK1KDM1A
SCHEMBL31324070 0.82 NTSR1 (0.65) NPY1RNTSR2NTSR1
SCHEMBL31324069 0.82 NTSR1 (0.65) NPY1RNTSR2NTSR1
SCHEMBL13807698 0.82 NMUR2 (0.57) EPHA2KDM1ANPY2RNPY4RNPY5R
SCHEMBL9807306 0.82 EPHA2 (0.62) EPHA2OPRM1OPRK1KDM1A
SCHEMBL31257023 0.82 EPHA2 (0.57) EPHA2NTSR2NTSR1
SCHEMBL9807252 0.82 EPHA2 (0.62) EPHA2OPRM1OPRK1KDM1A

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-20090156507-A1 Cell permeable conjugates of peptides for inhibition of protein kinases CUREGENICS LTD. 2009-06-18 — — 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-20090156507-A1 Cell permeable conjugates of peptides for inhibition of protein kinases MAP3K20, MAP3K19, MAP4K2 EPHA2 557/4885OPRM1 4537/4885OPRK1 2084/4885

“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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