SCHEMBL6408059

SCHEMBL6408059

CCCC[C@@H](C(=O)N(C)OC)N(C(=O)O)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.36
CA1 P00915 2/20 0.36
MAPK1 P28482 1/20 0.35
PDF Q9HBH1 3/20 0.35
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34
SLC1A3 P43003 1/20 0.34
JAK3 P52333 1/20 0.31
BTK Q06187 1/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GRIK1 P39086 1/20 0.30
GRIK2 Q13002 1/20 0.30

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
SCHEMBL1642220 0.84 FAAH (0.32)
SCHEMBL14910212 0.84 FAAH (0.32)
SCHEMBL12475634 0.84 FAAH (0.32)
SCHEMBL6675478 0.81 CA2 (0.36) CA2CA1MAPK1PDFSLC1A2
SCHEMBL29941035 0.81 FAAH (0.32)
SCHEMBL19458517 0.81 FAAH (0.32)
SCHEMBL19458516 0.81 FAAH (0.32)
SCHEMBL6675474 0.81 CA2 (0.36) CA2CA1MAPK1PDFSLC1A2
SCHEMBL8647680 0.78 MAPK1 (0.32) MAPK1
SCHEMBL9103138 0.77 KMT2A (0.41) JAK3BTKMEN1HPGDKMT2A

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-20050107616-A1 Alpha-ketoamide derivatives as cathepsin k inhibitors SMITHKLINE BEECHAM CORPORATION 2005-05-19 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-20050107616-A1 Alpha-ketoamide derivatives as cathepsin k inhibitors CTSK, CTSE, CTSZ CA2 931/4885CA1 1387/4885MAPK1 3649/4885

“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.