SCHEMBL25660941

SCHEMBL25660941

NCCCC[C@H](NC(=O)C1CCCC1)C(=O)CN1C=CCN=C1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSB P07858 9/20 0.50
CTSK P43235 5/20 0.50
CTSS P25774 5/20 0.50
CTSH P09668 4/20 0.50
CTSL P07711 4/20 0.50
CTSF Q9UBX1 2/20 0.50
CTSV O60911 1/20 0.50
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38

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
SCHEMBL25658847 0.81 CTSB (0.50) CTSBCTSKCTSSCTSHCTSL
SCHEMBL25658807 0.81 CTSB (0.50) CTSBCTSKCTSSCTSHCTSL
SCHEMBL19982934 0.75 CTSB (0.51) CTSBCTSKCTSSCTSHCTSL
SCHEMBL25658790 0.75 CTSB (0.51) CTSBCTSKCTSSCTSHCTSL
SCHEMBL19982937 0.75 CTSB (0.51) CTSBCTSKCTSSCTSHCTSL
SCHEMBL19982936 0.75 CTSB (0.51) CTSBCTSKCTSSCTSHCTSL
SCHEMBL19982935 0.75 CTSB (0.51) CTSBCTSKCTSSCTSHCTSL
SCHEMBL25658832 0.75 CTSB (0.51) CTSBCTSKCTSSCTSHCTSL
SCHEMBL19982981 0.72 CTSK (0.52) CTSBCTSKCTSSCTSHCTSL
SCHEMBL19972771 0.72 CTSK (0.55) CTSBCTSKCTSSCTSHCTSL

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-20230142714-A1 KETONE INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2023-05-11 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-20230142714-A1 KETONE INHIBITORS OF LYSINE GINGIPAIN PHYKPL, ENPEP, PREP CTSB 282/4885CTSK 379/4885CTSS 512/4885

“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.