SCHEMBL15086643

SCHEMBL15086643

CC1(C[C@H](NC(=O)C2CC2)C(=O)NC2(C(O)C(N)=O)CCC2)CCCC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSS P25774 8/20 0.33
CTSL P07711 6/20 0.33
CTSK P43235 6/20 0.32
MME P08473 2/20 0.32
LMNA P02545 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL15064325 1.00 CTSS (0.33) CTSSCTSLCTSKMMELMNA
SCHEMBL15064608 0.86 CTSS (0.36) CTSSCTSLCTSK
SCHEMBL16908820 0.82 CTSS (0.34) CTSSCTSLCTSK
SCHEMBL15086637 0.82 CTSS (0.33) CTSSCTSLCTSK
SCHEMBL12069218 0.81 CTSS (0.53) CTSSCTSLCTSK
SCHEMBL15086646 0.80 CTSL (0.41) CTSSCTSLCTSK
SCHEMBL12070309 0.79 GRIK1 (0.31) LMNA
SCHEMBL12069223 0.78 TP53 (0.33) CTSSCTSLCTSKMME
SCHEMBL16408514 0.76 CTSS (0.33) CTSSCTSLCTSK
SCHEMBL15086600 0.76 CTSS (0.32) CTSSCTSLCTSK

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
US-20150025250-A1 CYSTEINE PROTEASE INHIBITORS MEDIVIR UK LTD 2015-01-22 US disclosed
US-8859505-B2 Cysteine protease inhibitors MEDIVIR UK LTD (GB) 2014-10-14 US disclosed
EP-2752404-A1 Cysteine protease inhibitors Medivir UK Ltd (GB) 2014-07-09 EP disclosed
US-20130172232-A1 CYSTEINE PROTEASE INHIBITORS MEDIVIR UK LTD (GB) 2013-07-04 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 (2 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-20150025250-A1 CYSTEINE PROTEASE INHIBITORS CTSB, CTSS, CTRB1 CTSS 2/4885CTSL 9/4885CTSK 13/4885
US-20130172232-A1 CYSTEINE PROTEASE INHIBITORS CTSB, CTSS, CTRB1 CTSS 2/4885CTSL 9/4885CTSK 13/4885

“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.