SCHEMBL4817847

SCHEMBL4817847

CNC(=O)NCCCC[C@H](NC(=O)O)C(O)C(=O)N[C@H](C)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.49
CASR P41180 1/20 0.49
POLB P06746 2/20 0.45
CTDSP1 Q9GZU7 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CTSK P43235 1/20 0.42
BMP1 P13497 7/20 0.41
NAAA Q02083 2/20 0.40
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL8354664 0.87 CTSK (0.48) EPHX2CASRPOLBCTDSP1MEN1
SCHEMBL8354345 0.85 EPHX2 (0.50) EPHX2CASRPOLBCTDSP1MEN1
Hydrochloric Acid SCHEMBL4815550 0.84 EPHX2 (0.49) EPHX2CASRPOLBCTDSP1MEN1
SCHEMBL4897025 0.83 POLB (0.46) EPHX2CASRPOLBCTDSP1MEN1
SCHEMBL4904605 0.83 POLB (0.44) EPHX2CASRPOLBCTDSP1MEN1
SCHEMBL4814646 0.82 POLB (0.50) CASRPOLBCTDSP1MEN1KMT2A
SCHEMBL4814666 0.82 POLB (0.50) CASRPOLBCTDSP1MEN1KMT2A
SCHEMBL4820525 0.82 POLB (0.67) POLBCTDSP1MEN1KMT2ACTSK
SCHEMBL5639478 0.82 POLB (0.67) POLBCTDSP1MEN1KMT2ACTSK
SCHEMBL4820530 0.82 POLB (0.67) POLBCTDSP1MEN1KMT2ACTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7402606-B2 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin K inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION (US) 2008-07-22 US disclosed
US-7282512-B2 Cycloalkyl ketoamides derivatives useful as cathepsin K inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2007-10-16 US disclosed
US-20050245596-A1 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin k inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION 2005-11-03 US disclosed
US-20050054819-A1 Cycloalkyl ketoamides derivatives useful as cathepsin k inhibitors SMITHKLINE BEECHAM CORPORATION 2005-03-10 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 (2 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-20050054819-A1 Cycloalkyl ketoamides derivatives useful as cathepsin k inhibitors CTSK, CTSS, CTSE EPHX2 2447/4885CASR 2818/4885POLB 2328/4885
US-20050245596-A1 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin k inhibitors for the treatment of bone loss CTSK, CTSB, CTSD EPHX2 2408/4885CASR 1463/4885POLB 2563/4885

“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.