SCHEMBL6462350

SCHEMBL6462350

CC(C)CC(NC(=O)OCc1ccccc1)C(=O)NC(CCc1ccccc1)C(O)c1nc(C(=O)N2CCc3ccccc32)co1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 11/20 0.45
CTSK P43235 12/20 0.45
CTSB P07858 2/20 0.45
PSMB1 P20618 1/20 0.42
CTSS P25774 4/20 0.42

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
SCHEMBL7042159 0.96 CTSK (0.45) CTSLCTSKCTSBPSMB1CTSS
SCHEMBL6063162 0.89 CTSL (0.45) CTSLCTSKCTSBCTSS
SCHEMBL6465769 0.87 ALDH1A1 (0.39) CTSS
SCHEMBL6061535 0.87 CTSK (0.51) CTSLCTSKCTSBPSMB1CTSS
SCHEMBL6063101 0.87 CTSK (0.52) CTSLCTSKCTSBPSMB1CTSS
SCHEMBL7042164 0.86 CTSL (0.46) CTSLCTSKCTSBCTSS
SCHEMBL6062791 0.86 CTSL (0.54) CTSLCTSKCTSBPSMB1CTSS
SCHEMBL6062616 0.84 CTSL (0.53) CTSLCTSKCTSBPSMB1CTSS
SCHEMBL6061832 0.84 CTSL (0.52) CTSLCTSKCTSBPSMB1CTSS
SCHEMBL6467335 0.83 CTSL (0.51) CTSLCTSKCTSBPSMB1CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1516877-A1 Amine derivatives as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-23 EP disclosed
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 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 (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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ CTSL 18/4885CTSK 32/4885CTSB 11/4885

“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.