SCHEMBL6788734

SCHEMBL6788734

Cc1cc(COc2ccc(S(=O)(=O)CC3(CC(=O)NO)CCCCN3C)cc2)c2ccccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 8/20 0.95
MMP2 P08253 5/20 0.76
ADAM17 P78536 15/20 0.76
MMP9 P14780 2/20 0.76

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
SCHEMBL6783379 0.98 MMP13 (1.00) MMP13MMP2ADAM17MMP9
Trifluoroacetic Acid SCHEMBL6785994 0.96 MMP13 (0.88) MMP13MMP2ADAM17MMP9
Trifluoroacetic Acid SCHEMBL7547767 0.93 MMP13 (0.91) MMP13MMP2ADAM17MMP9
Trifluoroacetic Acid SCHEMBL6787546 0.93 MMP13 (0.91) MMP13MMP2ADAM17MMP9
SCHEMBL6787256 0.89 MMP13 (0.84) MMP13MMP2ADAM17MMP9
SCHEMBL6790270 0.89 MMP2 (0.96) MMP13MMP2ADAM17MMP9
SCHEMBL6786764 0.87 MMP2 (1.00) MMP13MMP2ADAM17MMP9
SCHEMBL6794928 0.86 ADAM17 (1.00) MMP13MMP2ADAM17MMP9
SCHEMBL6795271 0.86 ADAM17 (1.00) MMP13MMP2ADAM17MMP9
Trifluoroacetic Acid SCHEMBL6788954 0.85 MMP13 (0.78) MMP13MMP2ADAM17MMP9

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-6825215-B2 N-HYDROXY-2-(2-(((4-((2-METHYL-4-QUINOLINYL)METHOXY)PHENYL) -SULFONYL)METHYL)-2-PYRROLIDINYL)ACETAMIDE, FOR EXAMPLE AND OTHER QUINOLINE CONTAINING N-HYDROXYACETAMIDE DERIVATIVES BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-11-30 US claimed
US-20020137734-A1 1,1-Disubstituted cyclic inhibitors of matrix metalloproteases and TNF-alpha BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-09-26 US claimed
US-6825215-B2 N-HYDROXY-2-(2-(((4-((2-METHYL-4-QUINOLINYL)METHOXY)PHENYL) -SULFONYL)METHYL)-2-PYRROLIDINYL)ACETAMIDE, FOR EXAMPLE AND OTHER QUINOLINE CONTAINING N-HYDROXYACETAMIDE DERIVATIVES BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-11-30 US disclosed
US-20020137734-A1 1,1-Disubstituted cyclic inhibitors of matrix metalloproteases and TNF-alpha BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-09-26 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-20020137734-A1 1,1-Disubstituted cyclic inhibitors of matrix metalloproteases and TNF-alpha MMP1, MMP8, MMP9 MMP13 15/4885MMP2 6/4885ADAM17 13/4885

“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.