SCHEMBL2845552

SCHEMBL2845552

O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)NO

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 6/20 0.68
MEP1A Q16819 2/20 0.68
ALDH1A1 P00352 2/20 0.65
KMT2A Q03164 4/20 0.62
MEN1 O00255 3/20 0.62
MMP13 P45452 9/20 0.60
MMP1 P03956 8/20 0.60
MMP8 P22894 8/20 0.60
MMP2 P08253 8/20 0.60
MMP9 P14780 8/20 0.60
MMP7 P09237 1/20 0.59
MMP12 P39900 1/20 0.59
ADAM17 P78536 2/20 0.59
ADAM10 O14672 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
TP53 P04637 1/20 0.58
MAPT P10636 1/20 0.58
MMP14 P50281 2/20 0.58
MMP3 P08254 1/20 0.58

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
SCHEMBL7338644 0.87 MEP1B (0.81) MEP1BMEP1AALDH1A1MMP13MMP1
SCHEMBL5295487 0.84 TAS2R14 (0.64) ALDH1A1KMT2AMEN1MAPTTAS2R14
SCHEMBL13899083 0.84 MMP2 (0.67) MEP1BMEP1AMMP13MMP1MMP8
SCHEMBL7918690 0.83 CA1 (0.60) MEP1BMEP1AALDH1A1KMT2AMEN1
SCHEMBL26769801 0.82 MEP1B (0.65) MEP1BALDH1A1KMT2AMEN1MMP13
SCHEMBL4540959 0.81 MEN1 (0.64) ALDH1A1KMT2AMEN1MAPTTAS2R14
SCHEMBL7686664 0.81 MMP2 (0.57) MEP1BMEP1AALDH1A1MMP13MMP1
SCHEMBL7351771 0.81 MMP3 (0.85) MEP1BMMP13MMP1MMP8MMP2
SCHEMBL7350511 0.80 MEP1B (0.78) MEP1BMEP1AALDH1A1MMP13MMP1
SCHEMBL5899440 0.80 TAS2R14 (0.63) MEP1BMEP1AALDH1A1KMT2AMEN1

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101679220-A Histone deacetylase inhibitor METHYLGENE INC 2010-03-24 CN claimed
EP-2139850-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2010-01-06 EP claimed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 US claimed
WO-2008122115-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2008-10-16 WO claimed
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
CN-101679220-A Histone deacetylase inhibitor METHYLGENE INC 2010-03-24 CN disclosed
US-7659293-B2 α-Amino-N-hydroxy-acetamide derivatives NOVARTIS AG (CH) 2010-02-09 US disclosed
EP-2139850-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2010-01-06 EP disclosed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 US disclosed
EP-0766672-B1 ARYLSULFONAMIDO-SUBSTITUTED HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS NOVARTIS AG (CH) 2000-10-04 EP disclosed
EP-0606046-B1 Arylsulfonamido-substituted hydroxamic acids CIBA GEIGY AG (CH) 1997-10-08 EP disclosed
US-5646167-A ADMINISTERED AS METALLOPROTEINASE INHIBITOR, ANTITUMOR OR ANTICARCINOGENIC AGENT CIBA-GEIGY CORPORATION (US) 1997-07-08 US disclosed
WO-1996040101-A1 CERTAIN ARYLSULFONAMIDO-SUBSTITUTED HYDROXAMIC ACIDS FOR THE TREATMENT OF CERTAIN TUMORS NOVARTIS AG (CH) 1996-12-19 WO disclosed
US-5552419-A METALLOPROTEINASE INHIBITORS CIBA-GEIGY CORPORATION (US) 1996-09-03 US disclosed
US-5506242-A METALLOELASTASE INHIBITOR; TREATS EMPHYSEMA CIBA-GEIGY CORPORATION (US) 1996-04-09 US disclosed
US-5455258-A Useful as inhibitors of matrix-degrading metalloproteinase enzymes such as stromelysin and/or collegenase CIBA-GEIGY CORPORATION (US) 1995-10-03 US disclosed
EP-0606046-A1 Arylsulfonamido-substituted hydroxamic acids CIBA-GEIGY AG (CH) 1994-07-13 EP 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 MEP1B 1705/4885MEP1A 1954/4885ALDH1A1 532/4885

“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.