SCHEMBL12650697

SCHEMBL12650697

COc1ccc(-c2ccc(S(=O)(=O)N(OC(C)C)[C@H](CCN)C(=O)NO)cc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 20/20 0.81
MMP9 P14780 19/20 0.81
MMP14 P50281 14/20 0.77
MMP1 P03956 13/20 0.77
MMP3 P08254 12/20 0.77
MMP13 P45452 11/20 0.77
MMP8 P22894 3/20 0.58
MMP16 P51512 3/20 0.56
ADAM17 P78536 2/20 0.56
NPC1 O15118 1/20 0.56
MMP12 P39900 1/20 0.56
MTOR P42345 1/20 0.56
RAB9A P51151 1/20 0.56
MMP7 P09237 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56

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
SCHEMBL18193394 0.88 MMP2 (0.66) MMP2MMP9MMP14MMP1MMP3
SCHEMBL1783672 0.87 MMP2 (1.00) MMP2MMP9MMP14MMP1MMP3
SCHEMBL18193637 0.85 MMP2 (0.79) MMP2MMP9MMP14MMP1MMP3
SCHEMBL1782200 0.82 MMP2 (1.00) MMP2MMP9MMP14MMP1MMP3
SCHEMBL1785805 0.81 MMP2 (1.00) MMP2MMP9MMP14MMP1MMP3
SCHEMBL12605291 0.79 MMP2 (0.51) MMP2MMP9MMP14MMP1MMP3
SCHEMBL12609294 0.78 MMP2 (0.81) MMP2MMP9MMP14MMP1MMP3
SCHEMBL12609305 0.78 MMP2 (0.81) MMP2MMP9MMP14MMP1MMP3
SCHEMBL3228660 0.77 MMP2 (0.78) MMP2MMP9MMP14MMP1MMP3
SCHEMBL1784100 0.76 MMP2 (1.00) MMP2MMP9MMP14MMP1MMP3

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-20110117015-A1 Diagnostic Agents Selective Against Metalloproteases BRACCO IMAGING S.P.A. (IT) 2011-05-19 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-20110117015-A1 Diagnostic Agents Selective Against Metalloproteases MMP3, MMP7, MMP9 MMP2 9/4885MMP9 3/4885MMP14 20/4885

“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.