SCHEMBL4540959

SCHEMBL4540959

COC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
PTPN1 P18031 2/20 0.63
ALDH1A1 P00352 1/20 0.57
MAPT P10636 3/20 0.57
TAS2R14 Q9NYV8 6/20 0.56
PTGES O14684 1/20 0.55
TAS2R8 Q9NYW2 1/20 0.55
CXCR3 P49682 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
BMP1 P13497 1/20 0.53
CNR2 P34972 1/20 0.52

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
SCHEMBL15705617 0.92 MAPT (0.65) MEN1KMT2APTPN1ALDH1A1MAPT
SCHEMBL15705623 0.92 DAGLA (0.58) MEN1KMT2APTPN1MAPTTAS2R14
SCHEMBL5295487 0.83 TAS2R14 (0.64) MEN1KMT2AALDH1A1MAPTTAS2R14
SCHEMBL2845552 0.81 MEP1B (0.68) MEN1KMT2AALDH1A1MAPTTAS2R14
SCHEMBL5093686 0.79 ALDH1A1 (0.72) ALDH1A1TAS2R14PTGESTAS2R8CXCR3
SCHEMBL5092519 0.79 KEAP1 (0.81) ALDH1A1TAS2R14PTGESTAS2R8CXCR3
SCHEMBL5899440 0.79 TAS2R14 (0.63) MEN1KMT2AALDH1A1MAPTTAS2R14
SCHEMBL984791 0.79 TAS2R14 (0.71) MEN1KMT2APTPN1ALDH1A1MAPT
SCHEMBL2513385 0.79 TAS2R14 (0.70) PTPN1ALDH1A1TAS2R14PTGESTAS2R8
SCHEMBL7338644 0.78 MEP1B (0.81) ALDH1A1TAS2R14PTGESTAS2R8CXCR3

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
EP-2139850-B1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC (CA) 2018-09-12 EP disclosed
US-9096565-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2015-08-04 US disclosed
US-9096565-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2015-08-04 US disclosed
US-9096565-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2015-08-04 US disclosed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 US disclosed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 US disclosed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 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 (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-20090181943-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC11, HDAC3 MEN1 1925/4885KMT2A 58/4885PTPN1 3163/4885

“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.