SCHEMBL6340411

SCHEMBL6340411

O=C(O)CNS(=O)(=O)c1ccc2oc3ccccc3c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 3/20 0.59
MMP13 P45452 2/20 0.59
HTT P42858 3/20 0.56
GAA P10253 3/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C19 P33261 2/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
KMT2A Q03164 2/20 0.56
KEAP1 Q14145 1/20 0.55
MMP1 P03956 1/20 0.55
LMNA P02545 3/20 0.55
MAPT P10636 2/20 0.55
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
HSD11B1 P28845 1/20 0.53
APEX1 P27695 1/20 0.52

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
SCHEMBL6342203 0.82 HTT (0.54) MMP12MMP13HTTGAACYP1A2
SCHEMBL25490128 0.82 HTT (0.58) MMP12MMP13HTTGAACYP1A2
SCHEMBL15896281 0.80 MMP12 (0.60) MMP12MMP13HTTGAACYP1A2
SCHEMBL25490135 0.79 ALDH1A1 (0.54) MMP12MMP13HTTGAACYP1A2
SCHEMBL28747284 0.79 MMP12 (0.66) MMP12MMP13HTTGAACYP1A2
SCHEMBL6342584 0.79 MMP12 (0.66) MMP12MMP13HTTGAACYP1A2
SCHEMBL6412998 0.78 MMP12 (0.56) MMP12MMP13HTTGAACYP1A2
SCHEMBL6413015 0.78 MMP12 (0.56) MMP12MMP13HTTGAACYP1A2
SCHEMBL7987526 0.78 KEAP1 (0.55) MMP12MMP13HTTGAACYP1A2
SCHEMBL6843967 0.78 MMP12 (0.58) MMP12MMP13HTTGAACYP1A2

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6624177-B1 Treating diseases in which matrix melatoproteinases are involved such as multiple sclerosis, atherosclerotic plaque rupture, restenosis, aortic aneurism, heart failure, periodontal disease, corneal ulceration, burns, decubital WARNER-LAMBERT COMPANY 2003-09-23 US claimed
EP-0931045-A1 MATRIX METALLOPROTEINASE INHIBITORS AND THEIR THERAPEUTIC USES WARNER-LAMBERT COMPANY (US) 1999-07-28 EP claimed
WO-1998009934-A1 MATRIX METALLOPROTEINASE INHIBITORS AND THEIR THERAPEUTIC USES WARNER-LAMBERT COMPANY (US) 1998-03-12 WO claimed
US-6906092-B2 Method of inhibiting matrix metalloproteinases WARNER-LAMBERT COMPANY (US) 2005-06-14 US disclosed
US-20050020607-A1 Statin-MMP inhibitor combinations NEWTON ROGER SCHOFIELD (US) 2005-01-27 US disclosed
US-20040176393-A1 Statin-MMP inhibitor combinations NEWTON ROGER SCHOFIELD (US) 2004-09-09 US disclosed
US-20040029945-A1 Method of inhibiting matrix metalloproteinases O'BRIEN PATRICK MICHAEL (US) 2004-02-12 US disclosed
EP-1366765-A1 Use of matrix metalloproteinase inhibitors for treating neurological disorders and promoting wound healing WARNER-LAMBERT COMPANY LLC (US) 2003-12-03 EP disclosed
US-6624177-B1 Treating diseases in which matrix melatoproteinases are involved such as multiple sclerosis, atherosclerotic plaque rupture, restenosis, aortic aneurism, heart failure, periodontal disease, corneal ulceration, burns, decubital WARNER-LAMBERT COMPANY 2003-09-23 US disclosed
US-6620835-B2 Sulfonamide-substituted benzothiophenes (that may be oxidized), carbazoles, fluorenes and fluorenones WARNER-LAMBERT COMPANY 2003-09-16 US disclosed
US-20030032665-A1 Method of inhibiting matrix metalloproteinases O'BRIEN PATRICK MICHAEL (US) 2003-02-13 US disclosed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO disclosed
EP-0946166-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1999-10-06 EP disclosed
WO-1999047138-A1 STATIN-MATRIX METALLOPROTEINASE INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-09-23 WO disclosed
US-5948780-A ADMINISTERING A METALLOPROTEINASE INHIBITOR WARNER-LAMBERT COMPANY (US) 1999-09-07 US disclosed
EP-0931045-A1 MATRIX METALLOPROTEINASE INHIBITORS AND THEIR THERAPEUTIC USES WARNER-LAMBERT COMPANY (US) 1999-07-28 EP disclosed
WO-1999032150-A1 ACE INHIBITOR-MMP INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-07-01 WO disclosed
WO-1998026773-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1998-06-25 WO disclosed
WO-1998025597-A2 METHOD FOR TREATING AND PREVENTING HEART FAILURE AND VENTRICULAR DILATATION WARNER-LAMBERT COMPANY (US) 1998-06-18 WO disclosed
WO-1998009934-A1 MATRIX METALLOPROTEINASE INHIBITORS AND THEIR THERAPEUTIC USES WARNER-LAMBERT COMPANY (US) 1998-03-12 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 (4 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-20040176393-A1 Statin-MMP inhibitor combinations MMP9, TIMP3, MMP3 MMP12 21/4885MMP13 13/4885HTT 1885/4885
US-20030032665-A1 Method of inhibiting matrix metalloproteinases MMP17, MMP1, MMP12 MMP12 3/4885MMP13 11/4885HTT 4767/4885
US-20040029945-A1 Method of inhibiting matrix metalloproteinases MMP17, MMP1, MMP12 MMP12 3/4885MMP13 11/4885HTT 4767/4885
US-20050020607-A1 Statin-MMP inhibitor combinations MMP9, TIMP3, MMP3 MMP12 21/4885MMP13 13/4885HTT 1885/4885

“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.