SCHEMBL6772059

SCHEMBL6772059

COc1ccc(-c2ccc(S(=O)(=O)NC(CC(C)(O)CCSc3nccn3C)C(=O)O)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.46
MMP13 P45452 13/20 0.46
MMP3 P08254 8/20 0.46
MMP1 P03956 7/20 0.46
MMP9 P14780 7/20 0.45
MMP8 P22894 3/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MMP7 P09237 2/20 0.43
ADAMTS4 O75173 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
SCHEMBL6775144 0.83 MMP2 (0.47) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6771334 0.81 MMP2 (0.48) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6772110 0.81 MMP2 (0.47) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6767990 0.80 MMP2 (0.45) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6732327 0.78 MMP13 (0.51) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6733081 0.78 MMP13 (0.54) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6732440 0.72 MMP13 (0.53) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6738950 0.69 MMP13 (0.57) MMP2MMP13MMP3MMP1MMP9
SCHEMBL6772240 0.69 MMP2 (0.52) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7492839 0.68 MMP2 (0.64) MMP2MMP13MMP3MMP1MMP9

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-20030225074-A1 Dihetero-substituted metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY 2003-12-04 US claimed
US-6566381-B1 For therapy of arthritis, cancer, cardiovascular disorder, skin disorder, ocular disorder, inflammation and gum disease THE PROCTER & GAMBLE COMPANY 2003-05-20 US claimed
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
US-6566381-B1 For therapy of arthritis, cancer, cardiovascular disorder, skin disorder, ocular disorder, inflammation and gum disease THE PROCTER & GAMBLE COMPANY 2003-05-20 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 MMP2 10/4885MMP13 42/4885MMP3 14/4885

“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.