SCHEMBL7043375

SCHEMBL7043375

Cc1cccc(CS(=O)(=O)C[C@H](NC(=O)c2ccsc2)C(=O)N[C@@H](CCc2ccccc2)C(=O)c2nc3ccccc3o2)n1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 13/20 0.40
CTSL P07711 2/20 0.40
CTSB P07858 2/20 0.40
CTSK P43235 2/20 0.40
PRSS8 Q16651 2/20 0.36
CASP3 P42574 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
FAAH O00519 1/20 0.35
CES1 P23141 1/20 0.35
DAGLA Q9Y4D2 1/20 0.35
CMA1 P23946 2/20 0.34
GART P22102 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
SCHEMBL6468406 0.90 CTSL (0.42) CTSSCTSLCTSBCTSKPRSS8
SCHEMBL6062022 0.83 CTSL (0.42) CTSSCTSLCTSBCTSKPRSS8
SCHEMBL7179322 0.83 CTSS (0.52) CTSSCTSLCTSBCTSKPRSS8
SCHEMBL6061819 0.82 CTSS (0.61) CTSSCTSLCTSBCTSKPRSS8
SCHEMBL6466567 0.78 CTSS (0.47) CTSSCTSLCTSBCTSKCASP3
SCHEMBL7182998 0.76 CTSS (0.52) CTSSCTSLCTSBCTSKPRSS8
SCHEMBL6465503 0.76 LONP1 (0.48) CTSSCTSLCTSBCTSKCMA1
SCHEMBL7049521 0.75 CTSS (0.46) CTSSCTSLCTSBCTSKPRSS8
SCHEMBL6464114 0.75 CTSS (0.61) CTSSCTSLCTSBCTSKPRSS8
SCHEMBL6062778 0.75 CTSL (0.41) CTSSCTSLCTSBCTSKPRSS8

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-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 CTSS 9/4885CTSL 18/4885CTSB 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.