SCHEMBL7039308

SCHEMBL7039308

CCC1COCC(=O)C1NC(=O)[C@@H](N)CC1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 3/20 0.33
CTSC P53634 1/20 0.33
AAK1 Q2M2I8 2/20 0.32
NAAA Q02083 2/20 0.31
METAP1 P53582 2/20 0.31
REN P00797 1/20 0.31
XIAP P98170 1/20 0.31
CIT O14578 1/20 0.31
CTSS P25774 2/20 0.31
CTSK P43235 2/20 0.30
CTSL P07711 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
SCHEMBL7037265 0.99 METAP2 (0.34) METAP2CTSCAAK1NAAAMETAP1
SCHEMBL7033232 0.91 METAP2 (0.34) METAP2CTSCAAK1NAAAMETAP1
SCHEMBL7036267 0.90 METAP2 (0.35) METAP2CTSCAAK1NAAAMETAP1
SCHEMBL7037428 0.86 AAK1 (0.35) METAP2CTSCAAK1NAAAMETAP1
SCHEMBL7034077 0.85 AAK1 (0.37) METAP2CTSCAAK1NAAAMETAP1
SCHEMBL7035056 0.82 CTSK (0.39) XIAPCTSSCTSKCTSL
SCHEMBL6515339 0.81 CTSL (0.42) CTSSCTSKCTSL
SCHEMBL6484623 0.78 CTSK (0.53) CTSSCTSKCTSL
SCHEMBL6484631 0.78 CTSK (0.53) CTSSCTSKCTSL
SCHEMBL14347626 0.77 NAAA (0.40) METAP2CTSCAAK1NAAAMETAP1

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-20030203900-A1 Cysteine protease inhibitors MEDIVIR UK LTD (GB) 2003-10-30 US claimed
US-20030203900-A1 Cysteine protease inhibitors MEDIVIR UK LTD (GB) 2003-10-30 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-20030203900-A1 Cysteine protease inhibitors CTSS, CTSE, CTSV METAP2 531/4885CTSC 24/4885AAK1 2535/4885

“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.