SCHEMBL6237324

SCHEMBL6237324

C[C@@H]1O[C@@H](C)CN(S(=O)(=O)c2ccc(OCc3ccoc3)cc2)[C@H]1C(=O)NO

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 20/20 0.55
MMP1 P03956 15/20 0.55
MMP3 P08254 9/20 0.55
MMP9 P14780 9/20 0.55
MMP13 P45452 7/20 0.51

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
SCHEMBL7130071 1.00 ADAM17 (0.55) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL6239527 0.90 ADAM17 (0.46) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL7138231 0.86 MMP1 (0.65) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL6241360 0.86 MMP1 (0.65) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL6237207 0.86 MMP1 (0.65) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL6427714 0.86 MMP1 (0.65) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL6239622 0.86 MMP1 (0.65) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL6234233 0.86 ADAM17 (0.58) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL6427715 0.86 MMP1 (0.65) ADAM17MMP1MMP3MMP9MMP13
SCHEMBL6233856 0.86 ADAM17 (0.43) ADAM17MMP1MMP3MMP9MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1104412-B1 TACE INHIBITORS PFIZER PROD INC (US) 2005-06-15 EP claimed
EP-1104412-A1 TACE INHIBITORS Pfizer Products Inc. (US) 2001-06-06 EP claimed
WO-2000009492-A1 TACE INHIBITORS PFIZER PRODUCTS INC. (US) 2000-02-24 WO claimed
EP-1104412-B1 TACE INHIBITORS PFIZER PROD INC (US) 2005-06-15 EP disclosed
EP-1487457-A1 COMBINATION OF AN IL-1/18 INHIBITOR WITH A TNF INHIBITOR FOR THE TREATMENT OF INFLAMMATION Pfizer Products Inc. (US) 2004-12-22 EP disclosed
US-20030143230-A1 Combination of an IL-1/18 inhibitor with a TNF inhibitor for the treatment of inflammation PFIZER INC. 2003-07-31 US disclosed
WO-2003045400-A1 COMBINATION OF AN IL-1/18 INHIBITOR WITH A TNF INHIBITOR FOR THE TREATMENT OF INFLAMMATION PFIZER PRODUCTS INC. (US) 2003-06-05 WO disclosed
EP-1104412-A1 TACE INHIBITORS Pfizer Products Inc. (US) 2001-06-06 EP disclosed
WO-2000009492-A1 TACE INHIBITORS PFIZER PRODUCTS INC. (US) 2000-02-24 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-20030143230-A1 Combination of an IL-1/18 inhibitor with a TNF inhibitor for the treatment of inflammation IL1A, IL1B, IL18 ADAM17 184/4885MMP1 61/4885MMP3 214/4885

“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.