SCHEMBL6808427

SCHEMBL6808427

CS(=O)(=O)N1CCC(c2ccc(F)cc2)CC1.O=C(CCCc1ncccn1)CS(=O)(=O)N1CCC(c2ccc(F)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 2/20 0.41
COMT P21964 1/20 0.40
USP5 P45974 1/20 0.38
IRAK4 Q9NWZ3 2/20 0.37
ENPP2 Q13822 4/20 0.37
DRD2 P14416 2/20 0.37
SYK P43405 2/20 0.36
KDR P35968 1/20 0.36
CYP11B2 P19099 1/20 0.36
MCHR1 Q99705 1/20 0.35
EGFR P00533 1/20 0.35

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
SCHEMBL940834 0.95 MMP3 (0.44) MMP3COMTUSP5DRD2MCHR1
SCHEMBL942368 0.89 MMP3 (0.46) MMP3COMTUSP5DRD2EGFR
SCHEMBL6808425 0.83 MMP3 (0.35) MMP3COMTUSP5DRD2EGFR
SCHEMBL6809063 0.77 MMP3 (0.43) MMP3USP5DRD2
SCHEMBL942270 0.74 DPP4 (0.49) COMTUSP5ENPP2CYP11B2
SCHEMBL12911295 0.73 MMP3 (0.52) MMP3COMTUSP5DRD2MCHR1
SCHEMBL12911467 0.73 KMT2A (0.41)
SCHEMBL5957737 0.71 ADAM17 (0.35)
SCHEMBL942531 0.70 MMP13 (0.43) COMT
SCHEMBL6839896 0.70 MMP13 (0.43) COMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127528-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-01 US 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-20040127528-A1 Metalloproteinase inhibitors MMP9, MMP10, MMP3 MMP3 3/4885COMT 2063/4885USP5 2007/4885

“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.