SCHEMBL7510092

SCHEMBL7510092

O=C(O)C1(CS(=O)(=O)c2ccccc2Oc2ccc(Cl)cc2)CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 4/20 0.43
ADAM17 P78536 4/20 0.43
MMP1 P03956 4/20 0.43
MMP9 P14780 3/20 0.43
MMP3 P08254 4/20 0.42
MMP10 P09238 3/20 0.42
MMP2 P08253 3/20 0.41
MMP7 P09237 2/20 0.41
MMP8 P22894 2/20 0.41
MMP14 P50281 2/20 0.41
ABCB11 O95342 1/20 0.41
MAPT P10636 1/20 0.40
HPGD P15428 2/20 0.38
HTT P42858 2/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PPARA Q07869 1/20 0.38
CCR8 P51685 1/20 0.36

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
SCHEMBL7638430 0.83 MMP1 (0.57) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7310372 0.71 MMP13 (0.76) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7411817 0.70 ADAM17 (0.53) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL9938067 0.69 MMP1 (0.77) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7448192 0.69 ADAMTS4 (0.43) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7510098 0.68 MMP9 (0.54) MMP13ADAM17MMP1MMP9MMP3
Chlorobenzene SCHEMBL28751598 0.68 OPRM1 (0.44) PTGDR2
SCHEMBL7506483 0.68 GAA (0.48) ABCB11MAPTHPGDHTTALDH1A1
SCHEMBL6790716 0.68 MMP1 (0.66) MMP13ADAM17MMP1MMP9MMP3
Hydroxyamine SCHEMBL5914637 0.68 MMP1 (0.74) MMP13ADAM17MMP1MMP9MMP3

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 MMP13 15/4885ADAM17 5/4885MMP1 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.