SCHEMBL7080532

SCHEMBL7080532

COc1ccc(S(=O)(=O)N2CC(C)(C)CN(S(=O)(=O)c3ccc(OC)cc3)C2C(=O)NO)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 20/20 1.00
MMP1 P03956 19/20 1.00
MMP9 P14780 18/20 1.00
MMP7 P09237 9/20 1.00
MMP12 P39900 1/20 1.00
MMP2 P08253 6/20 0.64
MMP13 P45452 4/20 0.64
MMP8 P22894 4/20 0.62
ADAM17 P78536 7/20 0.61

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
SCHEMBL10118093 0.92 MMP3 (0.85) MMP3MMP1MMP9MMP7MMP12
SCHEMBL7076739 0.87 MMP3 (0.77) MMP3MMP1MMP9MMP7MMP12
SCHEMBL7509736 0.87 MMP1 (1.00) MMP3MMP1MMP9MMP7MMP12
SCHEMBL7080356 0.85 MMP1 (0.73) MMP3MMP1MMP9MMP7MMP12
SCHEMBL7077683 0.85 MMP1 (1.00) MMP3MMP1MMP9MMP7MMP12
SCHEMBL7081790 0.84 MMP3 (1.00) MMP3MMP1MMP9MMP7MMP12
SCHEMBL11933919 0.82 MMP1 (0.90) MMP3MMP1MMP9MMP7MMP12
SCHEMBL7516075 0.81 MMP1 (0.68) MMP3MMP1MMP9MMP7MMP12
SCHEMBL7080466 0.80 MMP1 (0.66) MMP3MMP1MMP9MMP7MMP12
SCHEMBL7081687 0.79 MMP1 (0.71) MMP3MMP1MMP9MMP7MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024028417-A1 NEW COMPOSITION FOR THE TREATMENT AND/OR PREVENTION OF VITILIGO Institut National de la Santé et de la Recherche Médicale (FR) 2024-02-08 WO disclosed
US-10377818-B2 Method of treating glioma THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2019-08-13 US disclosed
US-9745567-B2 Compositions and methods for treating multiple sclerosis REVALESIO CORPORATION (US) 2017-08-29 US disclosed
US-20160222100-A1 Method of Treating Glioma THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2016-08-04 US disclosed
US-20120135959-A1 Metalloprotein inhibitors containing nitrogen based ligands REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2012-05-31 US disclosed
US-20120135959-A1 Metalloprotein inhibitors containing nitrogen based ligands REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2012-05-31 US disclosed
US-20100098659-A1 COMPOSITIONS AND METHODS FOR TREATING MATRIX METALLOPROTEINASE 9 (MMP9)-MEDIATED CONDITIONS REVALESIO CORPORATION (US) 2010-04-22 US disclosed
US-20100015235-A1 COMPOSITIONS AND METHODS FOR TREATING MULTIPLE SCLEROSIS REVALESIO CORPORATION (US) 2010-01-21 US disclosed
US-20100008997-A1 COMPOSITIONS AND METHODS FOR TREATING ASTHMA AND OTHER LUNG DISORDERS REVALESIO CORPORATION (US) 2010-01-14 US disclosed
US-20100004189-A1 COMPOSITIONS AND METHODS FOR TREATING CYSTIC FIBROSIS REVALESIO CORPORATION (US) 2010-01-07 US disclosed
US-20030130271-A1 1,3-Diheterocyclic metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY 2003-07-10 US disclosed
EP-0927168-B1 1,3-DIHETEROCYCLIC METALLOPROTEASE INHIBITORS PROCTER & GAMBLE (US) 2002-11-06 EP disclosed
US-6469000-B1 TREATING ARTHRITIS, CANCER, CARDIOVASCULAR DISORDERS, SKIN DISORDERS, OCULAR DISORDERS, INFLAMMATION AND GUM DISEASE THE PROCTER & GAMBLE CO. 2002-10-22 US disclosed
US-6465474-B1 TREATMENT OF SUCH AS OSTEOARTHITIS, RHEUMATOID ARTHRITIS, PREVENTION OR ARREST OF TUMOR GROWTH AND METASTASIS, CORNEAL ULCERATION, LACK OF CORNEAL HEALING, MACULAR DEGENERATION, PERIODONTAL DISEASE, GINGIVITIS THE PROCTER & GAMBLE COMPANY 2002-10-15 US disclosed
US-6150370-A 1,3-DINITROCYCLIC COMPOUND TREATS NUMEROUS DISEASES CAUSED BY UNDESIRED METALLOPROTEASE ACTIVITY, SUCH AS TUMOR METASTASIS, OSTEOARTHRITIS, RHEUMATOID ARTHRITIS, SKIN INFLAMMATION, ULCERATIONS, AND PERIODONTITIS THE PROCTER & GAMBLE COMPANY (US) 2000-11-21 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 (6 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-20100015235-A1 COMPOSITIONS AND METHODS FOR TREATING MULTIPLE SCLEROSIS GJA1, GJB2, GPR180 MMP3 3758/4885MMP1 1996/4885MMP9 2331/4885
US-20120135959-A1 Metalloprotein inhibitors containing nitrogen based ligands MMP8, MMP1, TIMP3 MMP3 11/4885MMP1 2/4885MMP9 4/4885
US-20030130271-A1 1,3-Diheterocyclic metalloprotease inhibitors ADAM17, TIMP3, MMP3 MMP3 3/4885MMP1 7/4885MMP9 5/4885
US-20100004189-A1 COMPOSITIONS AND METHODS FOR TREATING CYSTIC FIBROSIS CFTR, GJB2, KRAS MMP3 3582/4885MMP1 748/4885MMP9 3488/4885
US-20100098659-A1 COMPOSITIONS AND METHODS FOR TREATING MATRIX METALLOPROTEINASE 9 (MMP9)-MEDIATED CONDITIONS MMP9, MMP14, MMP10 MMP3 6/4885MMP1 12/4885MMP9 1/4885
US-20100008997-A1 COMPOSITIONS AND METHODS FOR TREATING ASTHMA AND OTHER LUNG DISORDERS RGS17, RGS16, CHRM3 MMP3 2197/4885MMP1 1856/4885MMP9 2038/4885

“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.