SCHEMBL6790716

SCHEMBL6790716

O=C(NO)C1(CS(=O)(=O)c2ccc(Oc3ccccc3)cc2)CCNCC1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 12/20 0.66
MMP13 P45452 11/20 0.66
MMP2 P08253 10/20 0.66
MMP9 P14780 9/20 0.66
MMP3 P08254 7/20 0.66
ADAM17 P78536 8/20 0.66
MMP14 P50281 7/20 0.61
MMP8 P22894 4/20 0.61
MMP10 P09238 3/20 0.61
ABCB11 O95342 1/20 0.61
MMP7 P09237 1/20 0.61
KCNH2 Q12809 1/20 0.47

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
SCHEMBL7310372 0.90 MMP13 (0.76) MMP1MMP13MMP2MMP9MMP3
SCHEMBL7681442 0.89 MMP1 (0.55) MMP1MMP13MMP2MMP9MMP3
SCHEMBL7306093 0.86 MMP1 (0.81) MMP1MMP13MMP2MMP9MMP3
SCHEMBL6785491 0.82 OPRM1 (0.50) MMP1MMP13MMP2MMP9MMP3
SCHEMBL6622931 0.81 MMP13 (0.50) MMP1MMP13MMP2MMP9MMP3
SCHEMBL6791098 0.81 ADAM17 (0.61) MMP1MMP13MMP2MMP9MMP3
SCHEMBL6789202 0.80 MMP13 (1.00) MMP1MMP13MMP2MMP9MMP3
SCHEMBL6795687 0.80 MMP1 (1.00) MMP1MMP13MMP2MMP9MMP3
SCHEMBL5919502 0.80 MMP13 (0.80) MMP1MMP13MMP2MMP9MMP3
SCHEMBL6753832 0.79 ADAM17 (1.00) MMP1MMP13MMP2MMP9ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040097487-A1 Aromatic sulfonyl alpha-cycloamino hydroxamic acid compounds G.D. SEARLE & CO. 2004-05-20 US disclosed
US-6638952-B1 Matrix metalloprotease inhibitors PHARMACIA CORPORATION 2003-10-28 US disclosed
EP-0983257-A4 AROMATIC SULFONYL ALPHA-CYCLOAMINO HYDROXAMIC ACID COMPOUNDS MONSANTO CO (US) 2001-05-02 EP disclosed
EP-0983257-A1 AROMATIC SULFONYL ALPHA-CYCLOAMINO HYDROXAMIC ACID COMPOUNDS Monsanto Company (US) 2000-03-08 EP disclosed
WO-1998039315-A1 AROMATIC SULFONYL ALPHA-CYCLOAMINO HYDROXAMIC ACID COMPOUNDS MONSANTO COMPANY (US) 1998-09-11 WO 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-20040097487-A1 Aromatic sulfonyl alpha-cycloamino hydroxamic acid compounds MMP1, MMP2, MMP10 MMP1 1/4885MMP13 10/4885MMP2 2/4885

“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.