SCHEMBL5516375

SCHEMBL5516375

CCC(OC(N)=O)C(=O)c1nc(C2CC2)no1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
FABP4 P15090 7/20 0.31
FABP5 Q01469 7/20 0.31
HSD11B1 P28845 1/20 0.31
POLB P06746 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30
KLK7 P49862 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
SCHEMBL5516368 1.00 SMN1; SMN2 (0.32) SMN1; SMN2FABP4FABP5HSD11B1POLB
SCHEMBL5955871 0.80 DPP4 (0.37) FABP4FABP5HSD11B1POLBCA1
SCHEMBL5525299 0.77 SMYD3 (0.42) CA1CA2CA9KLK7
SCHEMBL5525293 0.77 SMYD3 (0.42) CA1CA2CA9KLK7
SCHEMBL5526079 0.77 SMYD3 (0.42) CA1CA2CA9KLK7
SCHEMBL17897216 0.74 FABP4 (0.36) FABP4FABP5HSD11B1POLBCA1
SCHEMBL6433614 0.72 CA1 (0.40) FABP4FABP5HSD11B1POLBCA1
SCHEMBL14427060 0.72 FABP4 (0.33) FABP4FABP5HSD11B1POLB
SCHEMBL17898050 0.69 PIK3CG (0.36) FABP4FABP5HSD11B1POLBCA1
SCHEMBL6207925 0.68 CA1 (0.35) FABP4FABP5HSD11B1POLBCA1

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
EP-1744755-B1 COMPOUNDS AND COMPOSITIONS AS CATHEPSIN S INHIBITORS IRM LLC (BM) 2012-12-05 EP claimed
US-20070232606-A1 Compounds and Compositions as Cathepsin S Inhibitors IRM LLC (BM) 2007-10-04 US claimed
EP-1744755-B1 COMPOUNDS AND COMPOSITIONS AS CATHEPSIN S INHIBITORS IRM LLC (BM) 2012-12-05 EP disclosed
US-20070232606-A1 Compounds and Compositions as Cathepsin S Inhibitors IRM LLC (BM) 2007-10-04 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-20070232606-A1 Compounds and Compositions as Cathepsin S Inhibitors CTSS, CTSB, CTSF SMN1; SMN2 2512/4885FABP4 1378/4885FABP5 1655/4885

“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.