SCHEMBL6694916

SCHEMBL6694916

CC(c1ccc(C(=O)O)cc1)N1Cc2sc(C#CCc3ccc(F)cc3)cc2NC1=O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 13/20 0.36
MAPK1 P28482 4/20 0.35
HSD11B1 P28845 1/20 0.34
METAP2 P50579 2/20 0.33

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
SCHEMBL6813767 0.82 MMP13 (0.39)
SCHEMBL6912473 0.74 MMP13 (0.38) PTGER4MAPK1HSD11B1
SCHEMBL6706893 0.73 MAPK1 (0.45) MAPK1
SCHEMBL6289361 0.72 MAPK1 (0.38) MAPK1
SCHEMBL6694969 0.70 MAPK1 (0.38) MAPK1
SCHEMBL6694914 0.70 MMP13 (0.39) PTGER4
SCHEMBL6916599 0.67 MMP13 (0.38) PTGER4MAPK1
SCHEMBL6735961 0.67 MMP13 (0.36) MAPK1
SCHEMBL6471978 0.67 MMP13 (0.36) PTGER4MAPK1HSD11B1
SCHEMBL6736341 0.67 MMP13 (0.39) PTGER4MAPK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors WILSON MICHAEL WILLIAM (US) 2004-02-26 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-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 PTGER4 1609/4885MAPK1 1571/4885HSD11B1 1363/4885

“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.