SCHEMBL3880125

SCHEMBL3880125

Cc1cc(COc2ccc(S(=O)(=O)CC(O)C=C3CCOCC3)cc2)c2ccccc2n1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 19/20 0.77
MMP13 P45452 13/20 0.77
MMP3 P08254 12/20 0.77
MMP2 P08253 12/20 0.77
MMP17 Q9ULZ9 10/20 0.77
MMP9 P14780 10/20 0.77
ADAM33 Q9BZ11 1/20 0.54

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
SCHEMBL3881204 0.92 ADAM17 (0.65) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL3882853 0.89 ADAM17 (0.66) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL13956874 0.89 ADAM17 (0.74) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL3888928 0.87 ADAM17 (0.62) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL3881836 0.87 ADAM17 (1.00) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL3881137 0.82 ADAM17 (0.65) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL3881475 0.80 ADAM17 (0.61) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL3881480 0.80 ADAM17 (0.61) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL3883155 0.80 ADAM17 (0.73) ADAM17MMP13MMP3MMP2MMP17
SCHEMBL3881108 0.79 ADAM17 (0.63) ADAM17MMP13MMP3MMP2MMP17

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 20/4885MMP13 60/4885MMP3 55/4885

“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.