SCHEMBL7157707

SCHEMBL7157707

CN1C(=O)N(CCN([C@@H](C(=O)NO)c2ccccc2)S(=O)(=O)Cc2ccc3sccc3c2)C(=O)C1(C)C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 3/20 0.39
MMP2 P08253 2/20 0.39
MMP3 P08254 2/20 0.37
MMP9 P14780 1/20 0.37
REN P00797 1/20 0.32
CTSD P07339 1/20 0.32
BACE1 P56817 1/20 0.32
PLA2G7 Q13093 1/20 0.31
PER2 O15055 1/20 0.31
CRY1 Q16526 1/20 0.31
CRY2 Q49AN0 1/20 0.31
MMP1 P03956 1/20 0.30
ADAM17 P78536 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7157709 1.00 MMP13 (0.39) MMP13MMP2MMP3MMP9REN
SCHEMBL7118822 0.86 MMP2 (0.39) MMP13MMP2RENCTSDBACE1
SCHEMBL7118832 0.86 MMP2 (0.39) MMP13MMP2RENCTSDBACE1
SCHEMBL7123582 0.86 MMP2 (0.39) MMP13MMP2RENCTSDBACE1
SCHEMBL7128682 0.84 MMP2 (0.40) MMP13MMP2MEN1KMT2A
SCHEMBL7128688 0.84 MMP2 (0.40) MMP13MMP2MEN1KMT2A
SCHEMBL7156503 0.83 MMP13 (0.45) MMP13MMP2MMP3MMP9PER2
SCHEMBL7156500 0.83 MMP13 (0.45) MMP13MMP2MMP3MMP9PER2
SCHEMBL7156507 0.83 MMP13 (0.45) MMP13MMP2MMP3MMP9PER2
SCHEMBL7127883 0.81 ADAMTS5 (0.40) MMP13MMP2

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-20030134880-A1 Novel cd23 inhibitors SMITHKLINE BEECHAM P.L.C. (GB) 2003-07-17 US 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 (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-20030134880-A1 Novel cd23 inhibitors CD2, CD22, CD40 MMP13 335/4885MMP2 1392/4885MMP3 210/4885

“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.