SCHEMBL6405793

SCHEMBL6405793

CCCC[C@@H](C(=O)C(C#N)=P(c1ccccc1)(c1ccccc1)c1ccccc1)N(C(=O)O)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
MAPK1 P28482 2/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
PRSS1 P07477 1/20 0.32
CTSG P08311 1/20 0.32
CTRB1 P17538 1/20 0.32
CMA1 P23946 1/20 0.32
CTSS P25774 2/20 0.31
CTSL P07711 1/20 0.31
CNR2 P34972 1/20 0.31
CTSK P43235 4/20 0.31

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
SCHEMBL4908342 0.75 CTSK (0.37) NPSR1CTSSCTSLCNR2CTSK
SCHEMBL4897207 0.75 NPSR1 (0.37) SMN1; SMN2NPSR1CTSSCTSLCNR2
SCHEMBL5636940 0.74 CTSL (0.42) CTSSCTSLCNR2CTSK
SCHEMBL5636936 0.74 CTSL (0.42) CTSSCTSLCNR2CTSK
SCHEMBL6403135 0.74 CTSK (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2CTSS
SCHEMBL6403132 0.74 CTSK (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2CTSS
SCHEMBL4908428 0.74 CTSK (0.38) NPSR1CTSSCTSLCNR2CTSK
SCHEMBL6405369 0.73 CTSK (0.45) ALDH1A1MAPK1MEN1MAPTKMT2A
SCHEMBL6406252 0.73 CTSK (0.45) ALDH1A1MAPK1MEN1MAPTKMT2A
SCHEMBL6405372 0.73 CTSK (0.45) ALDH1A1MAPK1MEN1MAPTKMT2A

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 L3MBTL1 1689/4885ALDH1A1 2900/4885LMNA 736/4885

“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.