SCHEMBL7552046

SCHEMBL7552046

CCCCOc1ccc(S(=O)(=O)C2CCN(Cc3ccc(Cl)c(Cl)c3)C(C(=O)O)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.51
MMP9 P14780 2/20 0.51
MMP13 P45452 2/20 0.51
S1PR5 Q9H228 12/20 0.46
S1PR1 P21453 8/20 0.44
S1PR3 Q99500 5/20 0.43
HTR2A P28223 1/20 0.43
KCNH2 Q12809 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
UTS2R Q9UKP6 1/20 0.41
ADAM17 P78536 1/20 0.40

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
SCHEMBL7553439 0.91 MMP1 (0.49) MMP1MMP9MMP13S1PR5KCNH2
SCHEMBL7511232 0.89 S1PR5 (0.48) MMP1MMP9MMP13S1PR5S1PR1
SCHEMBL7512305 0.87 S1PR5 (0.47) MMP1MMP9MMP13S1PR5S1PR1
SCHEMBL7570327 0.85 MMP1 (0.53) MMP1MMP9MMP13S1PR5S1PR1
SCHEMBL7508054 0.85 MMP1 (0.51) MMP1MMP9MMP13S1PR5L3MBTL1
Hydroxyamine SCHEMBL7556400 0.84 MMP1 (0.50) MMP1MMP9MMP13S1PR5L3MBTL1
Hydroxyamine SCHEMBL7661687 0.84 MMP1 (0.51) MMP1MMP9MMP13S1PR5S1PR1
Hydroxyamine SCHEMBL7548046 0.82 L3MBTL1 (0.47) MMP1MMP9MMP13S1PR5S1PR1
SCHEMBL7510558 0.81 MMP1 (0.47) MMP1MMP9MMP13S1PR5HTR2A
SCHEMBL7515093 0.80 KCNH2 (0.46) S1PR5S1PR1KCNH2KDM4EALDH1A1

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-20020006922-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) 2002-01-17 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-20020006922-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 MMP1 7/4885MMP9 16/4885MMP13 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.