SCHEMBL12650481

SCHEMBL12650481

O=S(=O)(NOI)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.50
GAA P10253 2/20 0.50
MMP12 P39900 2/20 0.50
UQCRB P14927 2/20 0.49
MAPK1 P28482 2/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
RECQL P46063 1/20 0.49
KMT2A Q03164 1/20 0.49
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
HSD11B1 P28845 1/20 0.47
MMP2 P08253 7/20 0.47
ADAMTS4 O75173 2/20 0.47
CA14 Q9ULX7 1/20 0.47
TSHR P16473 1/20 0.46
MMP9 P14780 5/20 0.46

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
SCHEMBL4804640 0.81 ADAMTS4 (0.51) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL29039629 0.77 ADAMTS4 (0.47) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL1784104 0.77 ADAMTS4 (0.55) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL13485822 0.75 MMP2 (0.78) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL7946395 0.75 KMT2A (0.61) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL28937576 0.74 MMP1 (0.47) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL4802135 0.74 MMP1 (0.55) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL10780756 0.74 MMP1 (0.55) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL3906959 0.74 NR3C2 (0.61) MMP1GAAMMP12UQCRBMAPK1
SCHEMBL417467 0.74 CA1 (0.59) MMP1GAAMMP12UQCRBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110124653-A1 ARYL-SULPHONAMIDIC DIMERS AS METALLOPROTEASES INHIBITORS BRACCO IMAGING S.P.A. (IT) 2011-05-26 US disclosed
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 (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-20110124653-A1 ARYL-SULPHONAMIDIC DIMERS AS METALLOPROTEASES INHIBITORS MMP9, MMP1, MMP2 MMP1 2/4885GAA 209/4885MMP12 11/4885
US-20110117015-A1 Diagnostic Agents Selective Against Metalloproteases MMP3, MMP7, MMP9 MMP1 4/4885GAA 153/4885MMP12 8/4885

“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.