SCHEMBL1731983

SCHEMBL1731983

CCCCCNC(=O)C(Cc1ccc(N2CC(=O)NS2(=O)=O)cc1)NS(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.48
MMP9 P14780 9/20 0.48
MMP12 P39900 4/20 0.48
MMP14 P50281 4/20 0.48
MMP8 P22894 3/20 0.48
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
NPY5R Q15761 1/20 0.43
ADAMTS4 O75173 1/20 0.43
MAPK1 P28482 1/20 0.43
MMP3 P08254 1/20 0.42
MMP10 P09238 1/20 0.42
PTPN1 P18031 2/20 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
SCHEMBL1731666 1.00 MMP2 (0.48) MMP2MMP9MMP12MMP14MMP8
SCHEMBL1732454 0.96 ALDH1A1 (0.43) MMP2MMP9MMP12MMP14MMP8
SCHEMBL1732457 0.96 ALDH1A1 (0.43) MMP2MMP9MMP12MMP14MMP8
SCHEMBL1732123 0.92 MMP2 (0.48) MMP2MMP9MMP12MMP14ALDH1A1
SCHEMBL1732127 0.92 MMP2 (0.48) MMP2MMP9MMP12MMP14ALDH1A1
SCHEMBL1731665 0.88 NPY5R (0.43) MMP2MMP9ALDH1A1MAPTSMN1; SMN2
SCHEMBL1732343 0.88 NPY5R (0.43) MMP2MMP9ALDH1A1MAPTSMN1; SMN2
SCHEMBL3222057 0.84 PTPN1 (0.48) MMP2MMP9MMP12MMP14MMP8
SCHEMBL3222069 0.84 PTPN1 (0.48) MMP2MMP9MMP12MMP14MMP8
SCHEMBL1731260 0.84 PTPN1 (0.42) MMP2MMP9ALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1492780-B1 5-SUBSTITUTED 1,1-DIOXO-¬1,2,5 THIAZOLIDINE-3-ONE DERIVATIVES AS PTPASE 1B INHIBITORS NOVARTIS AG (CH) 2011-11-23 EP claimed
US-20080139576-A1 5-Substituted 1,1-Dioxo- 1,2,5- Thiadiazolidin-3-One Derivatives NOVARTIS AG (CH) 2008-06-12 US claimed
US-7291635-B2 5-substituted 1,1-dioxo-1,2,5,-thiadiazolidin-3-one derivatives NOVARTIS AG (CH) 2007-11-06 US claimed
US-20050090502-A1 Protein tyrosine phosphatase 1B inhibitors alone or incombination with other antidiabetic, antilipemic, anticholesterol or hypotensive agents NOVARTIS AG (CH) 2005-04-28 US claimed
US-20040023974-A1 Cyclic sulfamide derivatives and methods of use COPPOLA GARY MARK 2004-02-05 US claimed
EP-1492780-B1 5-SUBSTITUTED 1,1-DIOXO-¬1,2,5 THIAZOLIDINE-3-ONE DERIVATIVES AS PTPASE 1B INHIBITORS NOVARTIS AG (CH) 2011-11-23 EP disclosed
EP-2341049-A1 5-substituted 1,1-dioxo-[1,2,5]thiazolidine-3-one derivatives as PTPASE 1B inhibitors Novartis AG (CH) 2011-07-06 EP disclosed
US-20040023974-A1 Cyclic sulfamide derivatives and methods of use COPPOLA GARY MARK 2004-02-05 US 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 (3 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-20080139576-A1 5-Substituted 1,1-Dioxo- 1,2,5- Thiadiazolidin-3-One Derivatives PTPRS, PTPRJ, IRS1 MMP2 1353/4885MMP9 2531/4885MMP12 862/4885
US-20050090502-A1 Protein tyrosine phosphatase 1B inhibitors alone or incombination with other antidiabetic, antilipemic, anticholesterol or hypotensive agents PTPRS, PTPMT1, PTPN1 MMP2 1458/4885MMP9 2123/4885MMP12 760/4885
US-20040023974-A1 Cyclic sulfamide derivatives and methods of use PTPRS, PTPA, PTPMT1 MMP2 1075/4885MMP9 2382/4885MMP12 571/4885

“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.