SCHEMBL13954301

SCHEMBL13954301

CCC(C)NC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCCOCCOCCOC

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 7/20 0.75
▸ CTSK P43235 6/20 0.48
▸ CTSL P07711 2/20 0.46
▸ HTRA1 Q92743 1/20 0.45
▸ CTSS P25774 1/20 0.45
▸ PSMB5 P28074 1/20 0.45
▸ CTSB P07858 1/20 0.44

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
SCHEMBL13954130 1.00 CAPN1 (0.75) CAPN1CTSKCTSLHTRA1CTSS
SCHEMBL20880287 1.00 CAPN1 (0.75) CAPN1CTSKCTSLHTRA1CTSS
SCHEMBL8293720 0.97 CAPN1 (0.73) CAPN1CTSKCTSLHTRA1CTSS
SCHEMBL3837382 0.88 CAPN1 (0.75) CAPN1CTSKCTSLHTRA1CTSS
SCHEMBL19661345 0.88 CAPN1 (0.75) CAPN1CTSKCTSLHTRA1CTSS
SCHEMBL3837378 0.88 CAPN1 (0.75) CAPN1CTSKCTSLHTRA1CTSS
SCHEMBL21458032 0.87 CAPN1 (0.75) CAPN1CTSKCTSLCTSSCTSB
SCHEMBL20834985 0.87 CAPN1 (0.75) CAPN1CTSKCTSLCTSSCTSB
SCHEMBL4402033 0.87 CAPN1 (0.75) CAPN1CTSKCTSLCTSSCTSB
SCHEMBL20474484 0.85 CAPN1 (0.76) CAPN1CTSKCTSLHTRA1CTSS

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-7491705-B2 Alpha-ketoamide derivative, and production method and use thereof SENJU PHARMACEUTICAL CO., LTD. (JP) 2009-02-17 — — US disclosed
US-20070004643-A1 Alpha-ketoamide derivative, and production method and use thereof SENJU PHARMACEUTICAL CO., LTD. (JP) 2007-01-04 — — 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-20070004643-A1 Alpha-ketoamide derivative, and production method and use thereof CAPN1, CAPN2, CAPNS1 CAPN1 1/4885CTSK 251/4885CTSL 311/4885

“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.

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