SCHEMBL4892559

SCHEMBL4892559

CC(C)(C)OC(=O)[C@H](CO)NS(=O)(=O)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.52
ADAMTS5 Q9UNA0 1/20 0.52
MMP9 P14780 6/20 0.50
MMP13 P45452 3/20 0.50
MMP1 P03956 2/20 0.50
MMP3 P08254 2/20 0.50
MMP7 P09237 2/20 0.50
MMP8 P22894 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
MMP14 P50281 1/20 0.46
STS P08842 1/20 0.45
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
RECQL P46063 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL4892574 1.00 MMP2 (0.52) MMP2ADAMTS5MMP9MMP13MMP1
SCHEMBL1186363 0.84 STS (0.46) MMP2ADAMTS5MMP9MMP13MMP1
SCHEMBL7357601 0.82 MMP2 (0.52) MMP2MMP9MMP13MMP1MMP3
SCHEMBL5730703 0.80 MMP2 (0.71) MMP2ADAMTS5MMP9MMP13MMP1
SCHEMBL14602227 0.80 MMP2 (0.71) MMP2ADAMTS5MMP9MMP13MMP1
SCHEMBL1185524 0.79 MMP2 (0.50) MMP2MMP9MMP13MMP1MMP3
SCHEMBL1186251 0.79 MMP2 (0.50) MMP2MMP9MMP13MMP1MMP3
SCHEMBL5033708 0.79 MMP2 (0.44) MMP2ADAMTS5MMP9MMP13MMP1
SCHEMBL5033703 0.79 MMP2 (0.44) MMP2ADAMTS5MMP9MMP13MMP1
SCHEMBL5033750 0.78 MMP2 (0.56) MMP2ADAMTS5MMP9MMP13MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080242656-A1 N-Substituted-N-Sulfonylaminocyclopropane Compounds and Pharmaceutical Use Thereof JAPAN TOBACCO INC. 2008-10-02 US disclosed
US-20080242656-A1 N-Substituted-N-Sulfonylaminocyclopropane Compounds and Pharmaceutical Use Thereof JAPAN TOBACCO INC. 2008-10-02 US disclosed
US-20080242656-A1 N-Substituted-N-Sulfonylaminocyclopropane Compounds and Pharmaceutical Use Thereof JAPAN TOBACCO INC. 2008-10-02 US disclosed
EP-1694638-A1 N-SUBSTITUTED-N-SULFONYLAMINOCYCLOPROPANE COMPOUNDS AND PHARMACEUTICAL USE THEREOF Japan Tobacco, Inc. (JP) 2006-08-30 EP disclosed
US-20050222146-A1 N-substituted-n-sulfonylaminocyclopropane compounds and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2005-10-06 US disclosed
WO-2005058808-A1 N-SUBSTITUTED-N-SULFONYLAMINOCYCLOPROPANE COMPOUNDS AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2005-06-30 WO disclosed
WO-2005058808-A1 N-SUBSTITUTED-N-SULFONYLAMINOCYCLOPROPANE COMPOUNDS AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2005-06-30 WO 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 (2 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-20080242656-A1 N-Substituted-N-Sulfonylaminocyclopropane Compounds and Pharmaceutical Use Thereof MMP13, MMP11, MMP3 MMP2 12/4885ADAMTS5 52/4885MMP9 7/4885
US-20050222146-A1 N-substituted-n-sulfonylaminocyclopropane compounds and pharmaceutical use thereof MMP13, MMP11, MMP1 MMP2 12/4885ADAMTS5 54/4885MMP9 6/4885

“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.