SCHEMBL7529490

SCHEMBL7529490

COc1ccc(CCN2CCC(S(=O)(=O)c3ccc(OC)cc3)CC2C(=O)NO)cc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 12/20 0.55
MMP8 P22894 2/20 0.55
MMP12 P39900 2/20 0.55
MMP1 P03956 15/20 0.52
ADAM17 P78536 2/20 0.52
MMP3 P08254 12/20 0.50
MMP7 P09237 11/20 0.50
MMP9 P14780 11/20 0.49
MMP2 P08253 5/20 0.48
NPC1 O15118 1/20 0.47

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
SCHEMBL7555596 0.89 MMP13 (0.47) MMP13MMP8MMP12MMP1ADAM17
SCHEMBL7505164 0.86 MMP1 (0.58) MMP13MMP8MMP12MMP1ADAM17
SCHEMBL7510882 0.85 MMP1 (0.57) MMP13MMP8MMP1ADAM17MMP3
SCHEMBL7505846 0.85 ALDH1A1 (0.49) MMP13MMP8MMP1
SCHEMBL7509176 0.85 MMP1 (0.51) MMP13MMP8MMP1ADAM17MMP3
SCHEMBL7618861 0.84 MMP1 (0.54) MMP13MMP8MMP1ADAM17MMP3
SCHEMBL7442655 0.83 MMP1 (0.57) MMP13MMP8MMP1ADAM17MMP3
SCHEMBL7621990 0.82 MMP13 (0.57) MMP13MMP8MMP12MMP1ADAM17
SCHEMBL7572878 0.81 ALDH1A1 (0.47) MMP13MMP8MMP1ADAM17MMP3
SCHEMBL7698774 0.80 MMP1 (0.54) MMP13MMP8MMP1ADAM17MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020188120-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) 2002-12-12 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-20020188120-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 17/4885MMP8 11/4885MMP12 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.