SCHEMBL10187427

SCHEMBL10187427

CC(=O)Cc1ccc(Oc2ccc(S(=O)(=O)CC3CO3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 17/20 0.60
▸ MMP1 P03956 2/20 0.60
▸ MMP9 P14780 16/20 0.54
▸ ALDH1A1 P00352 2/20 0.51
▸ POLB P06746 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ MMP8 P22894 10/20 0.51
▸ MEN1 O00255 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ MMP14 P50281 13/20 0.48
▸ MMP3 P08254 3/20 0.48
▸ MMP7 P09237 3/20 0.48

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
SCHEMBL10238686 0.88 MMP9 (0.71) MMP2MMP1MMP9ALDH1A1POLB
SCHEMBL10187462 0.84 MMP2 (0.67) MMP2MMP1MMP9ALDH1A1MMP8
SCHEMBL313439 0.82 MMP2 (0.71) MMP2MMP1MMP9ALDH1A1POLB
SCHEMBL12717274 0.82 MMP9 (0.78) MMP2MMP1MMP9MMP8MMP14
SCHEMBL12717348 0.81 MMP2 (0.69) MMP2MMP1MMP9ALDH1A1SMN1; SMN2
SCHEMBL17026726 0.80 MMP2 (0.58) MMP2MMP1MMP9MMP8MMP14
SCHEMBL4292169 0.79 MMP2 (0.67) MMP2MMP1MMP9ALDH1A1MMP8
SCHEMBL14727900 0.77 MMP2 (0.64) MMP2MMP1MMP9ALDH1A1MMP8
SCHEMBL17039173 0.77 MMP2 (0.55) MMP2MMP1MMP9MMP8MMP14
SCHEMBL314080 0.75 MMP2 (1.00) MMP2MMP1MMP9MMP8LMNA

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-8093287-B2 Inhibitors of matrix metalloproteinases UNIVERSITY OF NOTRE DAME DU LAC (US) 2012-01-10 — — US disclosed
US-20110224275-A1 INHIBITORS OF MATRIX METALLOPROTEINASES NOTRE DAME UNIVERSITY (US) 2011-09-15 — — 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-20110224275-A1 INHIBITORS OF MATRIX METALLOPROTEINASES MMP9, MMP1, MMP2 MMP2 3/4885MMP1 2/4885MMP9 1/4885

“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.

Send feedback