SCHEMBL6738796

SCHEMBL6738796

O=C(NO)C(NS(=O)(=O)Cc1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 2/20 0.45
MMP9 P14780 2/20 0.45
MMP8 P22894 1/20 0.45
MMP1 P03956 1/20 0.45
MMP13 P45452 1/20 0.45
ADAM17 P78536 1/20 0.45
HDAC8 Q9BY41 2/20 0.41
FCER2 P06734 2/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC1 Q13547 1/20 0.40

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
SCHEMBL6738793 1.00 MEP1B (0.45) MEP1BMMP9MMP8MMP1MMP13
SCHEMBL6733229 0.88 SLC1A3 (0.44) MMP9MMP8MMP13
SCHEMBL6733224 0.88 SLC1A3 (0.44) MMP9MMP8MMP13
SCHEMBL6738953 0.84 MEP1B (0.41) MEP1BMMP13HDAC8HDAC6HDAC1
SCHEMBL6743310 0.84 MEP1B (0.41) MEP1BHDAC8HDAC6HDAC1
SCHEMBL6738949 0.84 MEP1B (0.41) MEP1BMMP13HDAC8HDAC6HDAC1
SCHEMBL7061042 0.84 MEP1B (0.41) MEP1BHDAC8HDAC6HDAC1
SCHEMBL6740196 0.82 HDAC1 (0.39) MEP1BHDAC8HDAC6HDAC1
SCHEMBL6740192 0.82 HDAC1 (0.39) MEP1BHDAC8HDAC6HDAC1
SCHEMBL6739658 0.80 TSHR (0.45) MMP9MMP8MMP1MMP13ADAM17

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
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates SMITHKLINE BEECHAM P.L.C. 2004-11-11 US claimed
US-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives SMITHKLINE BEECHAM P.L.C. (GB) 2003-10-23 US claimed
EP-1244616-A1 (HETERO)BICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES SmithKline Beecham plc (GB) 2002-10-02 EP claimed
WO-2001047874-A1 (HETERO)BICYCLYMETHANESULFONYLAMINO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES SMITHKLINE BEECHAM P.L.C. (GB) 2001-07-05 WO claimed
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates SMITHKLINE BEECHAM P.L.C. 2004-11-11 US disclosed
US-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives SMITHKLINE BEECHAM P.L.C. (GB) 2003-10-23 US disclosed
EP-1244616-A1 (HETERO)BICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES SmithKline Beecham plc (GB) 2002-10-02 EP disclosed
WO-2001047874-A1 (HETERO)BICYCLYMETHANESULFONYLAMINO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES SMITHKLINE BEECHAM P.L.C. (GB) 2001-07-05 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-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives CD40, CD22, CD2 MEP1B 515/4885MMP9 964/4885MMP8 1071/4885
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates CD40, TNFRSF1A, CD2 MEP1B 484/4885MMP9 1073/4885MMP8 1161/4885

“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.