SCHEMBL6289024

SCHEMBL6289024

Cn1cc(Cc2ccc(F)c(F)c2)c(=O)c2cc(C#CCc3ccccc3)sc21

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 1/20 0.33
TOP2A P11388 1/20 0.32
TOP2B Q02880 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
ADRA1B P35368 1/20 0.32
MMP13 P45452 2/20 0.31
PDE3B Q13370 2/20 0.30
PDE3A Q14432 2/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL6288743 0.90 MMP13 (0.37) TOP2ATOP2BMMP13PDE3BPDE3A
SCHEMBL6292736 0.84 PLA2G7 (0.33) PLA2G7BRD4
SCHEMBL6289365 0.79 ADRA1A (0.34) PLA2G7ADRA1AHRH1ADRA1BMMP13
SCHEMBL6681942 0.74 MMP13 (0.46) MMP13
SCHEMBL6288786 0.73 PLA2G7 (0.35) PLA2G7TOP2ATOP2BADRA1AHRH1
SCHEMBL6292115 0.72 MMP13 (0.36) PLA2G7ADRA1AHRH1ADRA1BMMP13
SCHEMBL6289021 0.71 MMP13 (0.35) PLA2G7MMP13
SCHEMBL6484250 0.69 FFAR1 (0.33) PLA2G7
SCHEMBL6292839 0.69 MMP13 (0.38) PLA2G7TOP2ATOP2BMMP13PDE3B
SCHEMBL5957479 0.68 TRPA1 (0.49) MMP13

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-20040034054-A1 Fused bicyclic metalloproteinase inhibitors LINCOLN FOODSERVICE PRODUCTS INC. 2004-02-19 US claimed
WO-2004014375-A2 FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
US-6949651-B2 Fused bicyclic metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2005-09-27 US disclosed
US-20040034054-A1 Fused bicyclic metalloproteinase inhibitors LINCOLN FOODSERVICE PRODUCTS INC. 2004-02-19 US disclosed
WO-2004014375-A2 FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 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-20040034054-A1 Fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 PLA2G7 189/4885TOP2A 338/4885TOP2B 384/4885

“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.