SCHEMBL4424095

SCHEMBL4424095

CC(C)C(NS(=O)(=O)c1ccc(-c2ccc(Br)cc2)cc1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 17/20 1.00
MMP3 P08254 15/20 1.00
MMP13 P45452 15/20 1.00
MMP1 P03956 14/20 1.00
MMP7 P09237 14/20 1.00
MMP9 P14780 14/20 1.00
MMP14 P50281 1/20 1.00
ADAMTS4 O75173 3/20 0.78
MMP8 P22894 1/20 0.71

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
SCHEMBL7404078 1.00 MMP2 (1.00) MMP2MMP3MMP13MMP1MMP7
SCHEMBL4433724 1.00 MMP2 (1.00) MMP2MMP3MMP13MMP1MMP7
SCHEMBL8283336 0.95 MMP2 (0.91) MMP2MMP3MMP13MMP1MMP7
SCHEMBL27611876 0.95 MMP2 (0.91) MMP2MMP3MMP13MMP1MMP7
SCHEMBL4653257 0.88 MMP2 (1.00) MMP2MMP3MMP13MMP1MMP7
SCHEMBL32691806 0.88 MMP2 (1.00) MMP2MMP3MMP13MMP1MMP7
SCHEMBL1750956 0.88 MMP2 (1.00) MMP2MMP3MMP13MMP1MMP7
SCHEMBL7082523 0.87 MMP2 (1.00) MMP2MMP3MMP13MMP1MMP7
SCHEMBL7864111 0.87 MMP2 (1.00) MMP2MMP3MMP13MMP1MMP7
SCHEMBL7409278 0.87 MMP2 (1.00) MMP2MMP3MMP13MMP1MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050020607-A1 Statin-MMP inhibitor combinations NEWTON ROGER SCHOFIELD (US) 2005-01-27 US claimed
US-20040176393-A1 Statin-MMP inhibitor combinations NEWTON ROGER SCHOFIELD (US) 2004-09-09 US claimed
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 claimed
EP-1047450-B1 ACE INHIBITOR-MMP INHIBITOR COMBINATIONS WARNER LAMBERT CO (US) 2002-10-02 EP claimed
US-20020049237-A1 Statin-MMP inhibitor combinations NEWTON ROGER SCHOFIELD (US) 2002-04-25 US claimed
US-6340709-B1 ADMINISTERING BIPHENYLSULFONAMIDE DERIVATIVE WARNER-LAMBERT COMPANY 2002-01-22 US claimed
JP-2001526631-A 2001-12-18 JP claimed
EP-0901466-B1 BIPHENYLSULFONAMIDE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2001-10-31 EP claimed
CN-1310629-A Combined administration of ACAT and MMP inhibitors for the treatment of atherosclerotic lesions WARNER LAMBERT CO (US) 2001-08-29 CN claimed
JP-2001507342-A 2001-06-05 JP claimed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO claimed
EP-0946166-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1999-10-06 EP claimed
WO-1999047138-A1 STATIN-MATRIX METALLOPROTEINASE INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-09-23 WO claimed
US-5948780-A ADMINISTERING A METALLOPROTEINASE INHIBITOR WARNER-LAMBERT COMPANY (US) 1999-09-07 US claimed
WO-1999032150-A1 ACE INHIBITOR-MMP INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-07-01 WO claimed
EP-0901466-A1 BIPHENYLSULFONAMIDE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1999-03-17 EP claimed
WO-1998026773-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1998-06-25 WO claimed
WO-1998025597-A2 METHOD FOR TREATING AND PREVENTING HEART FAILURE AND VENTRICULAR DILATATION WARNER-LAMBERT COMPANY (US) 1998-06-18 WO claimed
US-5756545-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS WARNER-LAMBERT COMPANY (US) 1998-05-26 US claimed
WO-1997044315-A1 BIPHENYLSULFONAMIDE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1997-11-27 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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 MMP2 19/4885MMP3 3/4885MMP13 13/4885
US-20050020607-A1 Statin-MMP inhibitor combinations MMP9, TIMP3, MMP3 MMP2 19/4885MMP3 3/4885MMP13 13/4885
US-20020049237-A1 Statin-MMP inhibitor combinations MMP9, TIMP3, MMP3 MMP2 19/4885MMP3 3/4885MMP13 13/4885

“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.