SCHEMBL3078558

SCHEMBL3078558

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(-c3nc(C(F)(F)F)cs3)cc12)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 20/20 0.70
MMP13 P45452 2/20 0.70
MMP2 P08253 1/20 0.70
MMP3 P08254 1/20 0.70
MMP7 P09237 1/20 0.70
MMP9 P14780 1/20 0.70
MMP8 P22894 1/20 0.70

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
SCHEMBL3078517 0.90 MMP12 (0.65) MMP12MMP13MMP2MMP3MMP7
SCHEMBL3088176 0.88 MMP12 (0.72) MMP12MMP13MMP2MMP3MMP7
SCHEMBL3080518 0.87 MMP12 (0.68) MMP12MMP13MMP2MMP3MMP7
SCHEMBL3079400 0.84 MMP12 (0.69) MMP12MMP13MMP2MMP3MMP7
SCHEMBL4013227 0.83 MMP12 (0.63) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4017196 0.83 MMP12 (0.63) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3077557 0.83 MMP12 (0.72) MMP12MMP13MMP2MMP3MMP7
SCHEMBL3081114 0.82 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP7
SCHEMBL3085661 0.82 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP7
SCHEMBL3065654 0.82 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP7

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-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 US claimed
US-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 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-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS MMP13, MMP2, MMP12 MMP12 3/4885MMP13 1/4885MMP2 2/4885

“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.