SCHEMBL1126415

SCHEMBL1126415

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NC1NC(=O)NC1=O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCKAR P32238 4/20 0.60
CCKBR P32239 4/20 0.60
CTSS P25774 4/20 0.57
CTSK P43235 4/20 0.57
CTSL P07711 2/20 0.57
CTSB P07858 2/20 0.57
AKT1 P31749 1/20 0.53
SCN9A Q15858 6/20 0.53
IDO1 P14902 1/20 0.50
ACE P12821 1/20 0.50

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
SCHEMBL31628521 0.79 SCN9A (0.65) CCKARCCKBRCTSSCTSKCTSL
SCHEMBL20030540 0.78 SCN9A (0.56) CCKARCCKBRCTSSCTSKCTSL
SCHEMBL30279703 0.77 CTSS (0.73) CTSSCTSKCTSLCTSBAKT1
SCHEMBL6163314 0.77 CTSS (0.73) CTSSCTSKCTSLCTSBAKT1
SCHEMBL6163823 0.77 CTSS (0.73) CTSSCTSKCTSLCTSBAKT1
SCHEMBL6163323 0.77 CTSS (0.73) CTSSCTSKCTSLCTSBAKT1
SCHEMBL8951298 0.77 CTSS (0.73) CTSSCTSKCTSLCTSBAKT1
SCHEMBL22618478 0.77 CTSS (0.59) CCKARCCKBRCTSSCTSKCTSL
SCHEMBL22618535 0.77 CTSS (0.59) CCKARCCKBRCTSSCTSKCTSL
SCHEMBL21219305 0.76 ACE (0.72) CTSSCTSKCTSLCTSBAKT1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263486-A1 Inhibitors of Cancer Cell, T-Cell and Keratinocyte Proliferation 4SC AG (DE) 2011-10-27 US disclosed
EP-2284179-A2 Inhibitors of cancer cell, T-cell and keratinocyte proliferation 4SC AG (DE) 2011-02-16 EP disclosed
EP-2284178-A2 Inhibitors of cancer cell, T-cell and keratinocyte proliferation 4SC AG (DE) 2011-02-16 EP disclosed
US-20090176716-A1 INHIBITORS OF CANCER CELL, T-CELL AND KERATINOCYTE PROLIFERATION LEBAN JOHANN 2009-07-09 US disclosed
US-7531517-B2 Inhibitors of cancer cell, T-cell and keratinocyte proliferation 4SC AG (DE) 2009-05-12 US disclosed
US-20070037753-A1 Inhibitors of cancer cell, T-cell and keratinocyte proliferation 4SC AG (DE) 2007-02-15 US disclosed
EP-1752467-A1 Inhibitors of cancer cell, t-cell and keratinocyte proliferation 4SC AG (DE) 2007-02-14 EP 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 (3 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-20090176716-A1 INHIBITORS OF CANCER CELL, T-CELL AND KERATINOCYTE PROLIFERATION H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, EGFR, MKI67 CCKAR 166/4885CCKBR 427/4885CTSS 1617/4885
US-20070037753-A1 Inhibitors of cancer cell, T-cell and keratinocyte proliferation H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, EGFR, MKI67 CCKAR 150/4885CCKBR 346/4885CTSS 1523/4885
US-20110263486-A1 Inhibitors of Cancer Cell, T-Cell and Keratinocyte Proliferation H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, EGFR, MKI67 CCKAR 172/4885CCKBR 411/4885CTSS 1597/4885

“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.