SCHEMBL6020188

SCHEMBL6020188

CN(C#N)C(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccc(CCl)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.53
CTSB P07858 6/20 0.47
CTSS P25774 4/20 0.47
CTSK P43235 4/20 0.47
CA1 P00915 4/20 0.46
CA2 P00918 3/20 0.46
CA12 O43570 2/20 0.45
CA9 Q16790 2/20 0.45
LNPEP Q9UIQ6 1/20 0.44
RAB9A P51151 1/20 0.42
PTPN1 P18031 1/20 0.41
ITGB1 P05556 1/20 0.41
ITGA4 P13612 1/20 0.41

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
SCHEMBL6020919 0.91 CTSL (0.54) CTSLCTSBCTSSCTSKRAB9A
SCHEMBL6019209 0.88 CTSL (0.67) CTSLCTSBCTSSCTSKCA1
SCHEMBL6020450 0.88 CTSL (0.51) CTSLCTSBCTSSCTSKLNPEP
SCHEMBL6020953 0.87 CTSL (0.51) CTSLCTSBCTSSCTSKCA1
SCHEMBL6019931 0.86 CTSL (0.50) CTSLCTSBCTSSCTSKCA1
SCHEMBL6020748 0.84 CTSB (0.58) CTSLCTSBCTSSCTSKCA2
SCHEMBL6019517 0.84 CTSB (0.42) CTSLCTSBCTSSCTSKCA1
SCHEMBL6019808 0.82 CTSB (0.46) CTSLCTSBCTSSCTSKCA1
SCHEMBL6021764 0.81 CTSL (0.64) CTSLCTSBCTSSCTSKRAB9A
SCHEMBL5517750 0.81 CTSL (0.64) CTSLCTSBCTSSCTSKRAB9A

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 10 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-1575903-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES Jerini AG (DE) 2005-09-21 EP claimed
WO-2004065353-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES JERINI AG (DE) 2004-08-05 WO claimed
WO-2004056755-A2 COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES JERENI AG (DE) 2004-07-08 WO 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
WO-2004056755-A2 COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES JERENI AG (DE) 2004-07-08 WO 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 2274/4885CTSB 2514/4885CTSS 2720/4885

“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.