SCHEMBL6697733

SCHEMBL6697733

O=C(NO)C1(S(=O)(=O)c2ccc(-c3ccc(OC(F)(F)C(F)F)cc3)s2)CCOCC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 15/20 0.54
MMP9 P14780 15/20 0.54
MMP3 P08254 12/20 0.54
MMP1 P03956 12/20 0.54
MMP14 P50281 10/20 0.54
MMP13 P45452 18/20 0.49
MMP2 P08253 16/20 0.49
MMP7 P09237 2/20 0.45
ADAM17 P78536 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
SCHEMBL6227180 0.89 MMP9 (0.40) MMP8MMP9MMP3MMP1MMP14
SCHEMBL8316976 0.88 MMP8 (0.53) MMP8MMP9MMP3MMP1MMP14
SCHEMBL6231646 0.85 MMP9 (0.38) MMP8MMP9MMP3MMP1MMP14
SCHEMBL5908555 0.84 MMP9 (0.72) MMP8MMP9MMP3MMP1MMP14
SCHEMBL6230179 0.84 MMP8 (0.39) MMP8MMP9MMP3MMP1MMP14
SCHEMBL8321743 0.82 MMP13 (0.57) MMP8MMP9MMP3MMP1MMP14
SCHEMBL6206734 0.80 MMP13 (0.70) MMP8MMP9MMP3MMP1MMP14
SCHEMBL8316565 0.78 MMP8 (0.60) MMP8MMP9MMP3MMP1MMP14
SCHEMBL6231649 0.77 MMP13 (0.37) MMP9MMP1MMP13MMP2
Trifluoroacetic Acid SCHEMBL6226575 0.75 MMP8 (0.56) MMP8MMP9MMP3MMP1MMP14

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-20040142979-A1 Heteroarylsulfonylmethyl hydroxamic acids and amides and their use as protease inhibitors PHARMACIA CORPORATION 2004-07-22 US disclosed
WO-2004048368-A2 HETEROARYLSULFONYLMETHYL HYDROXAMIC ACIDS AND AMIDES AND THEIR USE AS PROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2004-06-10 WO 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-20040142979-A1 Heteroarylsulfonylmethyl hydroxamic acids and amides and their use as protease inhibitors MMP3, MMP13, MMP10 MMP8 28/4885MMP9 7/4885MMP3 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.