SCHEMBL1828592

SCHEMBL1828592

N/C(=N\S(=O)(=O)c1ccc(I)cc1)NCc1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.50
F2 P00734 2/20 0.48
PRSS1 P07477 2/20 0.48
PRSS2 P07478 2/20 0.48
PRSS3 P35030 2/20 0.48
CA1 P00915 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PRMT1 Q99873 1/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
GAA P10253 2/20 0.42
CA4 P22748 1/20 0.41
POLB P06746 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
SCHEMBL1828593 1.00 CA2 (0.50) CA2F2PRSS1PRSS2PRSS3
SCHEMBL1828512 0.90 SMN1; SMN2 (0.51) CA2CA1SMN1; SMN2PRMT1KMT2A
SCHEMBL1828515 0.90 SMN1; SMN2 (0.51) CA2CA1SMN1; SMN2PRMT1KMT2A
SCHEMBL1831544 0.88 KMT2A (0.53) CA2F2PRSS1PRSS2PRSS3
SCHEMBL1828432 0.88 CA2 (0.50) CA2F2PRSS1PRSS2PRSS3
SCHEMBL1829475 0.88 KMT2A (0.54) CA2F2PRSS1PRSS2PRSS3
SCHEMBL1830012 0.88 SMN1; SMN2 (0.53) CA2F2PRSS1PRSS2PRSS3
SCHEMBL1830014 0.88 SMN1; SMN2 (0.53) CA2F2PRSS1PRSS2PRSS3
SCHEMBL1832501 0.88 KMT2A (0.53) CA2F2PRSS1PRSS2PRSS3
SCHEMBL1828430 0.88 CA2 (0.50) CA2F2PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1320520-B1 SULFONYLGUANIDINE GRUENENTHAL GMBH (DE) 2011-05-11 EP claimed
US-7671074-B2 Sulfonylguanidine compounds and pharmaceutical uses thereof GRUENENTHAL GMBH (DE) 2010-03-02 US claimed
US-20080085900-A1 SULFONYLGUANIDINE COMPOUNDS AND PHARMACEUTICAL USES THEREOF GRUENENTHAL GMBH (DE) 2008-04-10 US claimed
US-20030225084-A1 Sulfonylguanidine compounds and pharmaceutical uses thereof GRUENENTHAL GMBH (DE) 2003-12-04 US claimed
EP-1320520-A1 SULFONYLGUANIDINE Grünenthal GmbH (DE) 2003-06-25 EP claimed
WO-2002030881-A1 SULFONYLGUANIDINE Grünenthal GmbH (DE) 2002-04-18 WO claimed
EP-1320520-B1 SULFONYLGUANIDINE GRUENENTHAL GMBH (DE) 2011-05-11 EP disclosed
US-7671074-B2 Sulfonylguanidine compounds and pharmaceutical uses thereof GRUENENTHAL GMBH (DE) 2010-03-02 US disclosed
US-7671074-B2 Sulfonylguanidine compounds and pharmaceutical uses thereof GRUENENTHAL GMBH (DE) 2010-03-02 US disclosed
US-7671074-B2 Sulfonylguanidine compounds and pharmaceutical uses thereof GRUENENTHAL GMBH (DE) 2010-03-02 US disclosed
US-20080085900-A1 SULFONYLGUANIDINE COMPOUNDS AND PHARMACEUTICAL USES THEREOF GRUENENTHAL GMBH (DE) 2008-04-10 US disclosed
US-20080085900-A1 SULFONYLGUANIDINE COMPOUNDS AND PHARMACEUTICAL USES THEREOF GRUENENTHAL GMBH (DE) 2008-04-10 US disclosed
US-20080085900-A1 SULFONYLGUANIDINE COMPOUNDS AND PHARMACEUTICAL USES THEREOF GRUENENTHAL GMBH (DE) 2008-04-10 US disclosed
US-20030225084-A1 Sulfonylguanidine compounds and pharmaceutical uses thereof GRUENENTHAL GMBH (DE) 2003-12-04 US disclosed
EP-1320520-A1 SULFONYLGUANIDINE Grünenthal GmbH (DE) 2003-06-25 EP disclosed
WO-2002030881-A1 SULFONYLGUANIDINE Grünenthal GmbH (DE) 2002-04-18 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-20080085900-A1 SULFONYLGUANIDINE COMPOUNDS AND PHARMACEUTICAL USES THEREOF CACNA1G, CACNA1I, CACNA1A CA2 401/4885F2 2763/4885PRSS1 1446/4885
US-20030225084-A1 Sulfonylguanidine compounds and pharmaceutical uses thereof CACNA1G, CACNA1I, CACNA1A CA2 401/4885F2 2763/4885PRSS1 1446/4885

“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.