SCHEMBL4076575

SCHEMBL4076575

CC(C)(C)OC(=O)N[C@H]1CCCN([P@@](N)(=O)NS(=O)(=O)O)C1=O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.57
F2 P00734 1/20 0.42
F10 P00742 1/20 0.42
PRSS1 P07477 1/20 0.42
GAA P10253 1/20 0.37
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CTSK P43235 2/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
BTK Q06187 1/20 0.33
MAP4K4 O95819 2/20 0.32

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
SCHEMBL4081541 1.00 DPP4 (0.57) DPP4F2F10PRSS1GAA
SCHEMBL4077281 1.00 DPP4 (0.57) DPP4F2F10PRSS1GAA
SCHEMBL4074092 1.00 DPP4 (0.57) DPP4F2F10PRSS1GAA
SCHEMBL4076580 1.00 DPP4 (0.57) DPP4F2F10PRSS1GAA
SCHEMBL4074086 1.00 DPP4 (0.57) DPP4F2F10PRSS1GAA
SCHEMBL4087538 0.85 F2 (0.49) DPP4F2F10PRSS1GAA
SCHEMBL4082879 0.85 F2 (0.49) DPP4F2F10PRSS1GAA
SCHEMBL4082868 0.85 F2 (0.49) DPP4F2F10PRSS1GAA
SCHEMBL4073916 0.78 DPP4 (0.51) DPP4GAACTSK
SCHEMBL4076662 0.78 DPP4 (0.51) DPP4GAACTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531657-B2 Method for preparing sulphostin and analogue thereof or preparation intermediate thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-05-12 US disclosed
US-20050020834-A1 Method for preparation of sulphostin and its analogue or intermediates thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2005-01-27 US disclosed
EP-1457494-A1 PROCESSES FOR PREPARATION OF SULPHOSTIN AND ITS ANALOGUES OR INTERMEDIATES THEREOF Nippon Kayaku Kabushiki Kaisha (JP) 2004-09-15 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 (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-20050020834-A1 Method for preparation of sulphostin and its analogue or intermediates thereof SOST, PTMS, FGF23 DPP4 987/4885F2 52/4885F10 696/4885

“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.