SCHEMBL6892988

SCHEMBL6892988

COc1ccc(-c2ccc(S(=O)(=O)NC(Sc3ncccc3C(F)(F)F)C3CC4OC4O3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
MMP13 P45452 15/20 0.38
ADAMTS4 O75173 1/20 0.38
MMP2 P08253 16/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
MMP3 P08254 13/20 0.37
MMP1 P03956 11/20 0.37
MMP7 P09237 9/20 0.37
MMP9 P14780 5/20 0.36
MMP8 P22894 5/20 0.36
MMP14 P50281 1/20 0.36

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
SCHEMBL6772015 0.71 MMP2 (0.47) MMP13ADAMTS4MMP2MMP3MMP1
SCHEMBL6767990 0.70 MMP2 (0.45) MMP13ADAMTS4MMP2MMP3MMP1
SCHEMBL6773324 0.69 HSD11B1 (0.39) HSD11B1GAAKMT2AMMP13ADAMTS4
SCHEMBL28410070 0.59 KMT2A (0.57) GAAKMT2A
SCHEMBL6773472 0.58 MMP2 (0.53) MMP13ADAMTS4MMP2MMP3MMP1
SCHEMBL18292532 0.58 POLB (0.72) KMT2A
SCHEMBL8712240 0.58 GAA (1.00) GAAKMT2A
SCHEMBL7497507 0.57 MMP2 (0.55) MMP13ADAMTS4MMP2MMP3MMP1
SCHEMBL6774033 0.57 MMP2 (0.55) MMP13ADAMTS4MMP2MMP3MMP1
SCHEMBL7762300 0.57 POLB (0.48) GAAMMP13ADAMTS4MMP2MMP3

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-6762198-B2 SUCH AS 2-((4'-METHOXY-(1,1'-BIPHENYL)-4-YL)-SULFONYL)-AMINO-3-(2-PHENOXYMETHYL -(1,3)DIOXAN-2-YL)PROPIONIC ACID THE PROCTER & GAMBLE COMPANY 2004-07-13 US disclosed
US-20030225074-A1 Dihetero-substituted metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY 2003-12-04 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-20030225074-A1 Dihetero-substituted metalloprotease inhibitors ADAM9, ADAM17, ADAM8 HSD11B1 503/4885GAA 89/4885KMT2A 1274/4885

“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.