SCHEMBL5966543

SCHEMBL5966543

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NC(CCCNC(=N)N)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 6/20 0.57
▸ CTSS P25774 5/20 0.57
▸ CTSB P07858 2/20 0.57
▸ CTSL P07711 1/20 0.57
▸ REN P00797 3/20 0.54
▸ AKT1 P31749 1/20 0.53
▸ ACE P12821 1/20 0.53
▸ GNPAT O15228 1/20 0.52
▸ PTPN1 P18031 1/20 0.51
▸ NPY4R P50391 1/20 0.49
▸ PPARG P37231 1/20 0.48
▸ PPARA Q07869 1/20 0.48
▸ ITGB3 P05106 1/20 0.48
▸ ITGA2B P08514 1/20 0.48

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
SCHEMBL22117445 1.00 CTSK (0.57) CTSKCTSSCTSBCTSLREN
SCHEMBL5966551 1.00 CTSK (0.57) CTSKCTSSCTSBCTSLREN
SCHEMBL22117446 1.00 CTSK (0.57) CTSKCTSSCTSBCTSLREN
SCHEMBL22117444 1.00 CTSK (0.57) CTSKCTSSCTSBCTSLREN
SCHEMBL22674864 0.97 CTSS (0.56) CTSKCTSSCTSBCTSLREN
SCHEMBL30645707 0.92 CTSS (0.58) CTSKCTSSNPY4RITGB3ITGA2B
SCHEMBL23680477 0.92 CTSK (0.59) CTSKCTSSCTSBCTSLREN
SCHEMBL23275569 0.92 CTSK (0.59) CTSKCTSSCTSBCTSLREN
SCHEMBL23275571 0.92 CTSK (0.59) CTSKCTSSCTSBCTSLREN
SCHEMBL7850315 0.91 CTSK (0.62) CTSKCTSSCTSBCTSLREN

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-20060128613-A1 Melanocortin receptor ligands THE PROCTER & GAMBLE COMPANY 2006-06-15 — — 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-20060128613-A1 Melanocortin receptor ligands MC3R, MC4R, MC1R CTSK 3132/4885CTSS 2475/4885CTSB 2294/4885

“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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