SCHEMBL6021241

SCHEMBL6021241

N#CCNC(=O)C(Cc1ccc(O)cc1)NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
CTSL P07711 5/20 0.55
MMP2 P08253 2/20 0.54
ADAMTS5 Q9UNA0 1/20 0.54
CTSS P25774 6/20 0.53
CTSK P43235 6/20 0.53
MMP9 P14780 1/20 0.47
CTSB P07858 5/20 0.47
TDP1 Q9NUW8 1/20 0.46
NLRP3 Q96P20 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
SCHEMBL6020328 0.91 MMP2 (0.65) CTSLMMP2ADAMTS5CTSSCTSK
SCHEMBL6020601 0.90 CTSL (0.64) MEN1KMT2AL3MBTL1CTSLMMP2
SCHEMBL6021345 0.89 MEN1 (0.50) MEN1KMT2AL3MBTL1CTSLMMP2
SCHEMBL6020558 0.87 ALDH1A1 (0.60) MEN1KMT2AL3MBTL1CTSLMMP2
SCHEMBL6019251 0.87 MMP2 (0.57) MEN1KMT2AL3MBTL1CTSLMMP2
SCHEMBL6021373 0.84 CTSB (0.57) CTSLMMP2ADAMTS5CTSSCTSK
SCHEMBL6020821 0.83 CTSS (0.53) MEN1KMT2AL3MBTL1CTSLMMP2
SCHEMBL6019308 0.82 CTSS (0.64) CTSLMMP2CTSSCTSKMMP9
SCHEMBL6020393 0.81 MMP2 (0.46) CTSLMMP2ADAMTS5CTSKMMP9
SCHEMBL6021409 0.81 RAB9A (0.47) CTSLMMP2ADAMTS5MMP9

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 12 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
EP-1575903-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES Jerini AG (DE) 2005-09-21 EP disclosed
WO-2004065353-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES JERINI AG (DE) 2004-08-05 WO 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 MEN1 4215/4885KMT2A 1324/4885L3MBTL1 1177/4885

“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.