SCHEMBL7510199

SCHEMBL7510199

COc1ccc(S(=O)(=O)C2CCN(CCCc3ccccc3)C(C(=O)O)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.51
HTR2A P28223 2/20 0.51
MMP1 P03956 2/20 0.48
MMP9 P14780 1/20 0.48
MMP13 P45452 1/20 0.48
ADAM17 P78536 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
SIGMAR1 Q99720 2/20 0.48
FKBP1A P62942 3/20 0.46
CHRM5 P08912 1/20 0.45
HTR2C P28335 1/20 0.45
OPRM1 P35372 1/20 0.44
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
ELOVL6 Q9H5J4 1/20 0.43

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 0.91 MMP13 (0.47) KCNH2HTR2AMMP1MMP9MMP13
SCHEMBL7555707 0.88 ALDH1A1 (0.50) HTR2AMMP1MMP9MMP13ADAM17
SCHEMBL7553070 0.88 MMP13 (0.46) MMP1MMP9MMP13ADAM17MEN1
SCHEMBL7956364 0.85 DRD3 (0.48) MMP1MMP9MMP13ADAM17MMP3
SCHEMBL7572878 0.85 ALDH1A1 (0.47) KCNH2HTR2AMMP1MMP9MMP13
Hydroxyamine SCHEMBL7551188 0.81 MMP13 (0.48) MMP1MMP9MMP13ADAM17MEN1
SCHEMBL7529490 0.80 MMP13 (0.55) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL7548378 0.80 MMP13 (0.46) MMP1MMP9MMP13ADAM17MEN1
SCHEMBL7510461 0.80 MMP13 (0.53) MMP1MMP9MMP13ADAM17MEN1
Hydroxyamine SCHEMBL7554322 0.80 MMP1 (0.46) KCNH2HTR2AMMP1MMP9MMP13

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 KCNH2 3171/4885HTR2A 3834/4885MMP1 7/4885

“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.