SCHEMBL6019769

SCHEMBL6019769

CC(C#N)NC(=O)C(Cc1ccc2ccccc2c1)NC(=O)c1cccc(CCl)c1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSL P07711 13/20 0.56
CTSS P25774 13/20 0.56
CTSB P07858 12/20 0.56
CTSK P43235 9/20 0.56
CTSV O60911 4/20 0.50
GPR139 Q6DWJ6 1/20 0.48
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46

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
SCHEMBL6019800 0.91 CTSB (0.64) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6019945 0.90 CTSL (0.58) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6020636 0.89 CTSL (0.69) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6021577 0.87 CTSL (0.73) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6020876 0.87 CTSL (0.56) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6020319 0.85 CTSL (0.59) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6019767 0.84 CTSL (0.60) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6021574 0.83 CTSL (0.51) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6020892 0.82 FNTA (0.47) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6020485 0.81 CTSL (0.60) CTSLCTSSCTSBCTSKCTSV

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 CTSL 2274/4885CTSS 2720/4885CTSB 2514/4885

“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.