SCHEMBL6785491

SCHEMBL6785491

CCOC(=O)C1(CS(=O)(=O)c2ccc(Oc3ccccc3)cc2)CCNCC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.50
MMP2 P08253 8/20 0.48
MMP13 P45452 7/20 0.48
ADAM17 P78536 5/20 0.48
MMP1 P03956 8/20 0.46
MMP9 P14780 4/20 0.46
MMP3 P08254 3/20 0.46
MMP8 P22894 3/20 0.44
MMP14 P50281 3/20 0.44
MAPT P10636 1/20 0.41
MMP7 P09237 2/20 0.41
ABCB11 O95342 1/20 0.41
MMP10 P09238 1/20 0.41
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41
CRHBP P24387 1/20 0.41
RAB9A P51151 1/20 0.41
CRHR2 Q13324 1/20 0.41

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
SCHEMBL7411817 0.90 ADAM17 (0.53) OPRM1MMP2MMP13ADAM17MMP1
SCHEMBL6785678 0.88 MMP2 (0.46) OPRM1MMP2MMP13ADAM17MMP1
SCHEMBL6790716 0.82 MMP1 (0.66) MMP2MMP13ADAM17MMP1MMP9
SCHEMBL6267625 0.81 ADAM17 (0.73) MMP2MMP13ADAM17MMP1MMP9
SCHEMBL6788984 0.81 MMP1 (0.73) MMP2MMP13ADAM17MMP1MMP9
SCHEMBL6785762 0.81 MMP1 (0.73) OPRM1MMP2MMP13ADAM17MMP1
SCHEMBL6784917 0.80 MMP13 (0.54) MMP2MMP13ADAM17MMP1MMP9
SCHEMBL7405315 0.80 MMP1 (0.48) OPRM1MMP2MMP13ADAM17MMP1
SCHEMBL5674788 0.78 POLB (0.46) OPRM1MAPTNPC1RAB9A
SCHEMBL7638430 0.77 MMP1 (0.57) MMP2MMP13ADAM17MMP1MMP9

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 OPRM1 4208/4885MMP2 2/4885MMP13 10/4885

“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.