SCHEMBL1859673

SCHEMBL1859673

O=C(C=Cc1ccn(S(=O)(=O)c2cccnc2)c1)NO

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 16/20 0.61
HDAC6 Q9UBN7 13/20 0.56
HDAC3 O15379 13/20 0.55
HDAC8 Q9BY41 12/20 0.55
HDAC2 Q92769 12/20 0.52
HDAC10 Q969S8 12/20 0.52
HDAC11 Q96DB2 12/20 0.52
HDAC9 Q9UKV0 12/20 0.52
HDAC4 P56524 12/20 0.52
HDAC7 Q8WUI4 11/20 0.52
HDAC5 Q9UQL6 11/20 0.52
NAMPT P43490 2/20 0.48
KDM1A O60341 1/20 0.46
ABL1 P00519 1/20 0.46
EGFR P00533 1/20 0.46
ERBB2 P04626 1/20 0.46
INSR P06213 1/20 0.46
PDGFRB P09619 1/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 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
SCHEMBL1859672 1.00 HDAC1 (0.61) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL296173 0.83 HDAC1 (0.60) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL296174 0.83 HDAC1 (0.60) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL296244 0.81 HDAC1 (0.52) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL296243 0.81 HDAC1 (0.52) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL297055 0.81 HDAC1 (0.62) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL297054 0.81 HDAC1 (0.62) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL1853301 0.80 HDAC1 (0.60) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL1853305 0.80 HDAC1 (0.60) HDAC1HDAC6HDAC3HDAC8HDAC2
SCHEMBL28157679 0.79 NAPRT (0.44) HDAC1NAMPT

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-1868994-B1 SULFONYLPYRROLES AS HISTONE DEACETYLASE INHIBITORS 4SC AG (DE) 2011-05-25 EP claimed
US-20090117074-A1 Sulfonylpyrroles as Histone Deacetylase Inhibitors NYCOMED GMBH (DE) 2009-05-07 US claimed
EP-1868994-A1 SULFONYLPYRROLES AS HISTONE DEACETYLASE INHIBITORS Nycomed GmbH (DE) 2007-12-26 EP claimed
WO-2006105979-A1 SULFONYLPYRROLES AS HISTONE DEACETYLASE INHIBITORS NYCOMED GMBH (DE) 2006-10-12 WO claimed
EP-1868994-B1 SULFONYLPYRROLES AS HISTONE DEACETYLASE INHIBITORS 4SC AG (DE) 2011-05-25 EP disclosed
US-20090117074-A1 Sulfonylpyrroles as Histone Deacetylase Inhibitors NYCOMED GMBH (DE) 2009-05-07 US disclosed
EP-1868994-A1 SULFONYLPYRROLES AS HISTONE DEACETYLASE INHIBITORS Nycomed GmbH (DE) 2007-12-26 EP disclosed
WO-2006105979-A1 SULFONYLPYRROLES AS HISTONE DEACETYLASE INHIBITORS NYCOMED GMBH (DE) 2006-10-12 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 (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-20090117074-A1 Sulfonylpyrroles as Histone Deacetylase Inhibitors HDAC1, HDAC3, HDAC2 HDAC1 1/4885HDAC6 8/4885HDAC3 2/4885

“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.