SCHEMBL6684348

SCHEMBL6684348

O=C(NOC1CCCCO1)C1(S(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)CCNCC1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 14/20 0.66
MMP14 P50281 14/20 0.66
MMP9 P14780 13/20 0.66
MMP8 P22894 11/20 0.66
MMP1 P03956 11/20 0.66
MMP13 P45452 11/20 0.66
MMP10 P09238 4/20 0.55
KCNH2 Q12809 2/20 0.55
MMP7 P09237 2/20 0.54
MMP2 P08253 6/20 0.53
ADAM17 P78536 1/20 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
SCHEMBL6685408 0.91 MMP13 (0.66) MMP3MMP14MMP9MMP8MMP1
SCHEMBL14993443 0.90 MMP3 (0.52) MMP3MMP14MMP9MMP8MMP1
SCHEMBL23839848 0.88 MMP14 (0.67) MMP3MMP14MMP9MMP8MMP1
SCHEMBL14992966 0.85 MMP13 (0.43) MMP3MMP14MMP9MMP8MMP1
SCHEMBL23828858 0.84 MMP14 (0.70) MMP3MMP14MMP9MMP8MMP1
SCHEMBL23839851 0.82 MMP14 (0.54) MMP3MMP14MMP9MMP8MMP1
SCHEMBL14817054 0.81 MMP9 (0.53) MMP3MMP14MMP9MMP8MMP1
SCHEMBL5908513 0.78 MMP8 (0.50) MMP3MMP14MMP9MMP8MMP1
SCHEMBL7396792 0.78 MMP3 (0.76) MMP3MMP14MMP9MMP8MMP1
SCHEMBL5919374 0.77 MMP13 (0.48) MMP3MMP14MMP9MMP8MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040235818-A1 Aromatic sulfone hydroxamic acid metalloprotease inhibitor PHARMACIA CORPORATION 2004-11-25 US disclosed
US-6750228-B1 UNCONTROLLED BREAKDOWN OF CONNECTIVE TISSUE BY METALLOPROTEASES IS A FEATURE OF MANY PATHOLOGICAL CONDITIONS PHARMACIA CORPORATION 2004-06-15 US disclosed
EP-1183239-A1 AROMATIC SULFONE HYDROXAMIC ACID METALLOPROTEASE INHIBITOR G.D. SEARLE & CO. (US) 2002-03-06 EP disclosed
WO-2000069821-A1 AROMATIC SULFONE HYDROXAMIC ACID METALLOPROTEASE INHIBITOR G.D. SEARLE & CO. (US) 2000-11-23 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-20040235818-A1 Aromatic sulfone hydroxamic acid metalloprotease inhibitor MMP9, MMP13, MMP2 MMP3 10/4885MMP14 7/4885MMP9 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.