SCHEMBL4563383

SCHEMBL4563383

CCCCCNS(=O)(=O)NCCCCC

nearest known ligand 0.86

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.86
CA1 P00915 5/20 0.84
CA2 P00918 5/20 0.84
CA12 O43570 3/20 0.84
CA14 Q9ULX7 3/20 0.84
CA7 P43166 2/20 0.84
CA9 Q16790 1/20 0.62
EPHX1 P07099 1/20 0.56
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL10892940 0.97 PPARA (0.91) PPARACA1CA2CA12CA14
SCHEMBL3792249 0.97 PPARA (0.91) PPARACA1CA2CA12CA14
SCHEMBL9285865 0.97 PPARA (0.91) PPARACA1CA2CA12CA14
SCHEMBL3120899 0.93 PPARA (1.00) PPARACA1CA2CA12CA14
SCHEMBL18644318 0.93 PPARA (1.00) PPARACA1CA2CA12CA14
SCHEMBL3117611 0.93 PPARA (1.00) PPARACA1CA2CA12CA14
SCHEMBL3119510 0.93 PPARA (1.00) PPARACA1CA2CA12CA14
Butyl(Butylsulfamoyl)Amine SCHEMBL2486301 0.92 CA1 (1.00) PPARACA1CA2CA12CA14
SCHEMBL3803009 0.91 PPARA (0.79) PPARACA1CA2CA12CA14
SCHEMBL21693509 0.87 PPARA (0.68) PPARACA1CA2CA12CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1962641-A Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2007-05-16 CN claimed
EP-1370556-B1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2006-07-19 EP claimed
EP-1404798-A4 PREPARATION OF CELLULOSIC MATERIALS NOVOZYMES NORTH AMERICA INC (US) 2004-08-04 EP claimed
US-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 US claimed
CN-1509273-A Metalloproteinase inhibitors 2004-06-30 CN claimed
CN-1509275-A Metalloproteinase inhibitors 2004-06-30 CN claimed
US-20040116486-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-06-17 US claimed
US-20040110809-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-06-10 US claimed
EP-1404798-A1 PREPARATION OF CELLULOSIC MATERIALS Novozymes North America, Inc. (US) 2004-04-07 EP claimed
EP-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP claimed
EP-1370538-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP claimed
EP-1370535-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP claimed
US-20030046773-A1 Preparation of cellulosic materials NOVOZYMES NORTH AMERICA, INC. 2003-03-13 US claimed
WO-2003002705-A1 PREPARATION OF CELLULOSIC MATERIALS NOVOZYMES NORTH AMERICA, INC. (US) 2003-01-09 WO claimed
WO-2002074752-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO claimed
WO-2002074749-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO claimed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO claimed
EP-0084718-B1 TRIPHENDIOXAZINE DYESTUFFS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-04-16 EP claimed
US-4565648-A FOR PRODUCTION OF POLYURETHANES BAYER AKTIENGESELLSCHAFT (DE) 1986-01-21 US claimed
EP-0075230-B1 ANAEROBICALLY CURABLE ADHESIVE Teroson GmbH (DE) 1984-06-06 EP 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 (2 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-20040110809-A1 Metalloproteinase inhibitors MMP9, MMP2, MMP3 PPARA 4256/4885CA1 362/4885CA2 341/4885
US-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 PPARA 3432/4885CA1 134/4885CA2 146/4885

“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.