SCHEMBL4811302

SCHEMBL4811302

CCCC[C@H](NC(=O)O)C(O)C(=O)Nc1ccn[nH]1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 17/20 0.50
PKM P14618 1/20 0.44
FFAR2 O15552 1/20 0.42
CTSS P25774 7/20 0.39
CTSL P07711 6/20 0.39
CTSV O60911 5/20 0.37
CTSB P07858 5/20 0.37
POLB P06746 1/20 0.34

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
SCHEMBL4811407 1.00 CTSK (0.50) CTSKPKMFFAR2CTSSCTSL
SCHEMBL6404414 1.00 CTSK (0.50) CTSKPKMFFAR2CTSSCTSL
SCHEMBL4811438 1.00 CTSK (0.50) CTSKPKMFFAR2CTSSCTSL
SCHEMBL6215913 1.00 CTSK (0.50) CTSKPKMFFAR2CTSSCTSL
SCHEMBL4811319 1.00 CTSK (0.50) CTSKPKMFFAR2CTSSCTSL
SCHEMBL6406209 0.86 FFAR2 (0.39) CTSKPKMFFAR2CTSSCTSL
SCHEMBL6405415 0.86 FFAR2 (0.39) CTSKPKMFFAR2CTSSCTSL
SCHEMBL6403784 0.86 FFAR2 (0.39) CTSKPKMFFAR2CTSSCTSL
SCHEMBL14105190 0.85 CTSK (0.50) CTSKPKMCTSSCTSLCTSV
SCHEMBL4820693 0.85 CTSK (0.50) CTSKPKMCTSSCTSLCTSV

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 2 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-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

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-20050245596-A1 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin k inhibitors for the treatment of bone loss CTSK, CTSB, CTSD CTSK 1/4885PKM 230/4885FFAR2 1392/4885

“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.