SCHEMBL3891961

SCHEMBL3891961

CC(=O)N(O)C(C=C1CCOSC1)CS(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 19/20 0.68
MMP3 P08254 13/20 0.68
MMP13 P45452 13/20 0.68
MMP2 P08253 12/20 0.68
MMP17 Q9ULZ9 11/20 0.68
MMP9 P14780 10/20 0.68
ADAM33 Q9BZ11 1/20 0.46

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
SCHEMBL13901191 0.88 ADAM17 (0.82) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL3884523 0.81 ADAM17 (0.81) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL3881836 0.81 ADAM17 (1.00) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL3881504 0.78 ADAM17 (1.00) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL3880125 0.77 ADAM17 (0.77) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL3996441 0.77 ADAM17 (1.00) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL3882853 0.75 ADAM17 (0.66) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL3998567 0.75 ADAM17 (0.84) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL13956874 0.75 ADAM17 (0.74) ADAM17MMP3MMP13MMP2MMP17
SCHEMBL3949306 0.74 ADAM17 (0.82) ADAM17MMP3MMP13MMP2MMP17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511144-B2 Reverse hydroxamic acid derivatives KAKEN PHARMACEUTICAL CO., LTD. (JP) 2009-03-31 US disclosed
EP-1431285-B1 REVERSE HYDROXAMIC ACID DERIVATIVES KAKEN PHARMA CO LTD (JP) 2009-01-07 EP disclosed
US-20040242928-A1 Tumor necrosis factor converting enzyme inhibitor; antiarthritic agents; lupus; Crohn's disease; multiple sclerosis; antidiabetic agents; infections;; asthma; skin disorders; anemia STUDOR S.A. (LU) 2004-12-02 US disclosed
EP-1431285-A1 REVERSE HYDROXAMIC ACID DERIVATIVES Kaken Pharmaceutical Co., Ltd. (JP) 2004-06-23 EP 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-20040242928-A1 Tumor necrosis factor converting enzyme inhibitor; antiarthritic agents; lupus; Crohn's disease; multiple sclerosis; antidiabetic agents; infections;; asthma; skin disorders; anemia TNF, RNASE1, IFNAR1 ADAM17 20/4885MMP3 55/4885MMP13 60/4885

“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.