SCHEMBL7212019

SCHEMBL7212019

CCCCN1CC(=O)N(CC(O)(CS(=O)(=O)c2ccc(Oc3ccccc3)cc2)C(=O)NO)C1=O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 17/20 0.50
MMP2 P08253 13/20 0.50
MMP1 P03956 10/20 0.50
MMP7 P09237 2/20 0.40
MMP9 P14780 2/20 0.37
MMP3 P08254 1/20 0.37
MMP8 P22894 1/20 0.37
MMP14 P50281 1/20 0.37
ADAM17 P78536 1/20 0.37

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
SCHEMBL7215310 0.92 MMP13 (0.41) MMP13MMP2MMP1MMP7MMP9
SCHEMBL7212175 0.90 MMP7 (0.48) MMP13MMP2MMP1MMP7MMP9
SCHEMBL7216329 0.87 MMP13 (0.55) MMP13MMP2MMP1MMP7MMP9
SCHEMBL7215401 0.87 MMP2 (0.50) MMP13MMP2MMP1MMP7MMP9
SCHEMBL7212024 0.83 HDAC6 (0.37) MMP13MMP2MMP1MMP7MMP9
SCHEMBL7210645 0.83 MMP7 (0.44) MMP13MMP2MMP1MMP7MMP9
SCHEMBL7215322 0.81 MMP7 (0.51) MMP13MMP2MMP1MMP7MMP9
SCHEMBL7212106 0.79 MMP13 (0.45) MMP13MMP2MMP1MMP7MMP9
SCHEMBL7210567 0.78 MMP2 (0.55) MMP13MMP2MMP1MMP9MMP3
SCHEMBL7216662 0.78 HDAC6 (0.35) MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030166687-A1 ALPHA-HYDROXY,-AMINO AND -FLUORO DERIVATIVES OF BETA-SULPHONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS PHARMACIA & UPJOHN COMPANY 2003-09-04 US claimed
EP-1037868-B1 $g(a)-HYDROXY, -AMINO, AND HALO DERIVATIVES OF $g(b)-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS UPJOHN CO (US) 2003-02-05 EP claimed
US-20030166687-A1 ALPHA-HYDROXY,-AMINO AND -FLUORO DERIVATIVES OF BETA-SULPHONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS PHARMACIA & UPJOHN COMPANY 2003-09-04 US disclosed
EP-1037868-B1 $g(a)-HYDROXY, -AMINO, AND HALO DERIVATIVES OF $g(b)-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS UPJOHN CO (US) 2003-02-05 EP disclosed
US-6437177-B1 DISEASES INVOLVING CONNECTIVE TISSUE DEGRADATION; ARTHRITIS, OSTEOPOROSIS, PERIODONTITIS, GINGIVITIS, CORNEAL, DERMAL, OR GASTRIC ULCERATION, AND ASTHMA; 2-HYDROXY-2-(PHENYLTHIO) METHYL-3-(4-BUTOXYBENZENESULFONYL)PROPIONIC ACID PHARMACIA & UPJOHN COMPANY 2002-08-20 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-20030166687-A1 ALPHA-HYDROXY,-AMINO AND -FLUORO DERIVATIVES OF BETA-SULPHONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS MMP1, MMP8, HRH3 MMP13 5/4885MMP2 8/4885MMP1 1/4885

“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.