SCHEMBL6019800

SCHEMBL6019800

CC(C#N)NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)c1ccc(CCl)cc1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSB P07858 13/20 0.64
CTSS P25774 12/20 0.64
CTSK P43235 10/20 0.64
CTSL P07711 10/20 0.64
CA2 P00918 1/20 0.50
CTSV O60911 2/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
PSMB5 P28074 1/20 0.47

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
SCHEMBL6020636 0.92 CTSL (0.69) CTSBCTSSCTSKCTSLCA2
SCHEMBL6019769 0.91 CTSL (0.56) CTSBCTSSCTSKCTSLCTSV
SCHEMBL6020485 0.88 CTSL (0.60) CTSBCTSSCTSKCTSLCTSV
SCHEMBL6021561 0.87 CTSS (0.61) CTSBCTSSCTSKCTSLCA2
SCHEMBL6020755 0.87 CTSL (0.84) CTSBCTSSCTSKCTSLCTSV
SCHEMBL6020964 0.84 CTSL (0.58) CTSBCTSSCTSKCTSLCA2
SCHEMBL6021216 0.84 CTSB (0.57) CTSBCTSSCTSKCTSLMMP9
SCHEMBL6019796 0.83 CTSL (0.68) CTSBCTSSCTSKCTSLCA2
SCHEMBL6021100 0.82 CTSS (0.57) CTSBCTSSCTSKCTSLCA2
SCHEMBL6021448 0.82 CTSS (0.60) CTSBCTSSCTSKCTSLMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060252813-A1 Apparatus for curing a composite laminate JERINI AG (DE) 2006-11-09 US claimed
EP-1433778-A1 Use of nitriles as rotamase inhibitors Jerini AG (DE) 2004-06-30 EP claimed
EP-1433779-A1 Use of nitriles as inhibitors of non-proteolytic enzymes Jerini AG (DE) 2004-06-30 EP claimed
US-20060252813-A1 Apparatus for curing a composite laminate JERINI AG (DE) 2006-11-09 US disclosed
EP-1433778-A1 Use of nitriles as rotamase inhibitors Jerini AG (DE) 2004-06-30 EP disclosed
EP-1433779-A1 Use of nitriles as inhibitors of non-proteolytic enzymes Jerini AG (DE) 2004-06-30 EP 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-20060252813-A1 Apparatus for curing a composite laminate DHX29, HDHD5, DHRS9 CTSB 2514/4885CTSS 2720/4885CTSK 2529/4885

“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.