SCHEMBL5342192

SCHEMBL5342192

COC(=O)[C@H]1[C@H]2OC(C)(C)O[C@@H]2[C@@H](O)CN1S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.81

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 17/20 0.81
MMP9 P14780 15/20 0.81
MMP1 P03956 14/20 0.81
ADAM17 P78536 11/20 0.81
MMP2 P08253 4/20 0.52
MMP7 P09237 2/20 0.51
MMP12 P39900 1/20 0.50
MMP13 P45452 3/20 0.48
PKM P14618 1/20 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
SCHEMBL5342363 1.00 MMP3 (0.81) MMP3MMP9MMP1ADAM17MMP2
SCHEMBL5338174 1.00 MMP3 (0.81) MMP3MMP9MMP1ADAM17MMP2
SCHEMBL5352447 0.90 MMP3 (0.67) MMP3MMP9MMP1ADAM17MMP2
SCHEMBL5351412 0.90 MMP3 (0.67) MMP3MMP9MMP1ADAM17MMP2
SCHEMBL5337192 0.90 MMP3 (1.00) MMP3MMP9MMP1ADAM17MMP2
SCHEMBL14532367 0.87 MMP3 (0.69) MMP3MMP9MMP1ADAM17MMP7
SCHEMBL5343121 0.86 MMP3 (0.81) MMP3MMP9MMP1ADAM17MMP2
SCHEMBL5351800 0.86 MMP3 (0.61) MMP3MMP9MMP1ADAM17MMP2
SCHEMBL5922442 0.86 ADAM17 (0.61) MMP3MMP9MMP1ADAM17MMP2
SCHEMBL5345757 0.86 MMP3 (0.67) MMP3MMP9MMP1ADAM17MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223779-B2 Azasugar derivative and drug containing the same as the active ingredient CARNA BIOSCIENCES INC. (JP) 2007-05-29 US disclosed
US-7223779-B2 Azasugar derivative and drug containing the same as the active ingredient CARNA BIOSCIENCES INC. (JP) 2007-05-29 US disclosed
US-7223779-B2 Azasugar derivative and drug containing the same as the active ingredient CARNA BIOSCIENCES INC. (JP) 2007-05-29 US disclosed
US-20050154017-A1 Novel azasugar derivative and drug containing the same as the active ingredient CARNA BIOSCIENCES INC. (JP) 2005-07-14 US disclosed
US-20050137221-A1 Novel azasugar derivative and drug containing the same as the active ingredient TSUKIDA TAKAHIRO (JP) 2005-06-23 US disclosed
EP-1516872-A1 NOVEL AZASUGAR DERIVATIVE AND DRUG CONTAINING THE SAME AS THE ACTIVE INGREDIENT Carna Biosciences Inc. (JP) 2005-03-23 EP 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-20050154017-A1 Novel azasugar derivative and drug containing the same as the active ingredient CDK8, DUT, CDK7 MMP3 2136/4885MMP9 1503/4885MMP1 815/4885
US-20050137221-A1 Novel azasugar derivative and drug containing the same as the active ingredient CDK8, DUT, CDK7 MMP3 2136/4885MMP9 1503/4885MMP1 815/4885

“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.