SCHEMBL7622281

SCHEMBL7622281

CCC(Cc1ccc(ON2CCOCC2)cc1)(C(=O)O)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 4/20 0.48
MMP9 P14780 3/20 0.48
MMP1 P03956 3/20 0.48
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 2/20 0.43
USP2 O75604 2/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 1/20 0.42
LMNA P02545 2/20 0.42
FKBP1A P62942 1/20 0.42
MEN1 O00255 1/20 0.42
GALR3 O60755 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
MMP3 P08254 1/20 0.41

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
SCHEMBL6929326 0.85 MMP1 (0.68) MMP13MMP9MMP1ALDH1A1KDM4E
SCHEMBL6928585 0.78 MMP9 (0.67) MMP13MMP9MMP1ALDH1A1KDM4E
Hydroxyamine SCHEMBL7644234 0.77 MMP9 (0.65) MMP13MMP9MMP1ALDH1A1KDM4E
SCHEMBL6934424 0.77 MMP1 (0.67) MMP13MMP9MMP1KDM4EMAPT
SCHEMBL6934723 0.75 MMP1 (0.65) MMP13MMP9MMP1ALDH1A1KDM4E
SCHEMBL6929373 0.75 MMP9 (0.78) MMP13MMP9MMP1MMP3
SCHEMBL6932195 0.74 MMP13 (0.63) MMP13MMP9MMP1ALDH1A1MMP3
SCHEMBL7697350 0.74 MMP1 (0.48) MMP13MMP9MMP1ALDH1A1KDM4E
SCHEMBL6934315 0.74 MMP1 (0.63) MMP13MMP9MMP1ALDH1A1KDM4E
SCHEMBL7699552 0.72 MMP13 (0.41) MMP13MMP9MMP1ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6441023-B1 FOR THERAPY OF ARTHRITIS, TUMOR METASTASIS, TISSUE ULCERATION, ABNORMAL WOUND HEALING, PERIODONTAL DISEASE, BONE DISEASE, DIABETES (INSULIN RESISTANCE) AND HIV INFECTION AMERICAN HOME PRODUCTS CORPORATION 2002-08-27 US disclosed
US-20020032186-A1 N-hydroxy-2-(alkyl, aryl, or heteroaryl sulfanyl, sulfinyl or sulfonyl)-3-substituted alkyl, aryl or heteroarylamides as matrix metalloproteinase inhibitors AMERICAN CYANAMID COMPANY (US) 2002-03-14 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-20020032186-A1 N-hydroxy-2-(alkyl, aryl, or heteroaryl sulfanyl, sulfinyl or sulfonyl)-3-substituted alkyl, aryl or heteroarylamides as matrix metalloproteinase inhibitors MMP12, ADAM33, MMP2 MMP13 27/4885MMP9 13/4885MMP1 4/4885

“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.