SCHEMBL7511347

SCHEMBL7511347

COc1ccc(-c2ccc(S(=O)(=O)CC(C)NOCc3ccccc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
POLB P06746 2/20 0.50
MMP13 P45452 9/20 0.48
MMP1 P03956 5/20 0.48
MMP2 P08253 6/20 0.47
MMP3 P08254 6/20 0.47
ADAMTS4 O75173 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MMP9 P14780 5/20 0.43
MMP8 P22894 3/20 0.43
HTT P42858 1/20 0.43
MMP12 P39900 1/20 0.43
MMP14 P50281 1/20 0.43
MMP16 P51512 1/20 0.43
MMP7 P09237 1/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42

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
SCHEMBL6381667 0.77 NPC1 (0.56) ALDH1A1POLBMMP13MMP1MMP2
SCHEMBL8440143 0.76 NPC1 (0.55) ALDH1A1POLBMMP13MMP1MMP2
SCHEMBL7550935 0.76 MMP13 (0.43) ALDH1A1POLBMMP13MMP1MMP2
SCHEMBL7368856 0.75 NPC1 (0.54) ALDH1A1MMP13MMP1MMP2MMP3
SCHEMBL7212002 0.75 NPC1 (0.51) ALDH1A1MMP13MMP1MMP2MMP3
SCHEMBL4873875 0.73 ALDH1A1 (0.64) ALDH1A1POLBMMP13MMP1MMP2
SCHEMBL8601705 0.72 MMP13 (0.49) ALDH1A1MMP13MMP1MMP2MMP3
SCHEMBL8601707 0.72 MMP13 (0.49) ALDH1A1MMP13MMP1MMP2MMP3
SCHEMBL7862144 0.72 MMP13 (0.48) ALDH1A1MMP13MMP1MMP2MMP3
SCHEMBL7869903 0.71 MMP13 (0.57) ALDH1A1MMP13MMP1MMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1001930-B1 N-HYDROXYFORMAMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2002-12-04 EP disclosed
US-20020007060-A1 Reverse hydroxamate inhibitors of matrix metalloproteinases DAVIDSEN STEVEN K (US) 2002-01-17 US disclosed
US-6294573-B1 FOR THERAPY RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, OSTEOPENIAS SUCH AS OSTEOPOROSIS, PERIODONTITIS, GINGIVITIS, CORNEAL, EPIDERMAL OR GASTRIC ULCERATION, AND TUMOR GROWTH AND METASTASIS OR INVASION ABBOTT LABORATORIES 2001-09-25 US disclosed
US-6235786-B1 RHEUMATIC DISORDERS; BONE DISORDERS; ORAL DISEASES; ANTIULCER AGENTS; ANTITUMOR AGENTS ABBOTT LABORATORIES 2001-05-22 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-20020007060-A1 Reverse hydroxamate inhibitors of matrix metalloproteinases MMP1, MMP9, MMP3 ALDH1A1 404/4885POLB 354/4885MMP13 15/4885

“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.