SCHEMBL6935695

SCHEMBL6935695

CC(C(=O)OCc1ccccc1)C(O)NC(=O)[C@H](CC1CCCCC1)NC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.60
CTSB P07858 5/20 0.60
CTSL P07711 5/20 0.60
CTSS P25774 5/20 0.60
REN P00797 1/20 0.53
CASP1 P29466 1/20 0.48

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
SCHEMBL14020888 0.85 CTSK (0.62) CTSKCTSBCTSLCTSSREN
SCHEMBL4800376 0.83 CTSK (0.67) CTSKCTSBCTSLCTSSCASP1
SCHEMBL4622697 0.83 CTSK (0.67) CTSKCTSBCTSLCTSSCASP1
SCHEMBL28546631 0.83 CTSK (0.67) CTSKCTSBCTSLCTSSCASP1
SCHEMBL6663697 0.83 CTSK (0.62) CTSKCTSBCTSLCTSSREN
SCHEMBL25289369 0.82 CTSK (0.63) CTSKCTSBCTSLCTSSCASP1
SCHEMBL25286871 0.82 CTSK (0.63) CTSKCTSBCTSLCTSSREN
SCHEMBL25247153 0.82 CTSK (0.63) CTSKCTSBCTSLCTSSREN
SCHEMBL25289368 0.82 CTSK (0.63) CTSKCTSBCTSLCTSSCASP1
SCHEMBL25282430 0.82 CTSK (0.65) CTSKCTSBCTSLCTSSCASP1

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-20030138864-A1 Method for identifying an enzyme to design anti-cancer compounds CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-07-24 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-20030138864-A1 Method for identifying an enzyme to design anti-cancer compounds RNASE1, GUSB, DPEP1 CTSK 333/4885CTSB 316/4885CTSL 526/4885

“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.