SCHEMBL6486505

SCHEMBL6486505

C[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](C=O)NC(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
SYK P43405 1/20 0.44
CTSK P43235 3/20 0.44
CTSL P07711 3/20 0.43
CTSS P25774 3/20 0.43
CTSB P07858 2/20 0.43
ITGB3 P05106 2/20 0.43
ITGA2B P08514 2/20 0.43
ELANE P08246 1/20 0.43
PSMB1 P20618 1/20 0.43
PSMB5 P28074 1/20 0.43
PSMB2 P49721 1/20 0.43
CTRB1 P17538 2/20 0.43

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
SCHEMBL8112640 1.00 ATM (0.51) ATMSYKCTSKCTSLCTSS
SCHEMBL17352430 0.84 ATM (0.53) ATMSYKCTSKCTSLCTSS
SCHEMBL23455705 0.84 ATM (0.53) ATMSYKCTSKCTSLCTSS
SCHEMBL23455707 0.84 ATM (0.53) ATMSYKCTSKCTSLCTSS
SCHEMBL6487029 0.84 ATM (0.53) ATMSYKCTSKCTSLCTSS
SCHEMBL23392518 0.83 ATM (0.52) ATMSYKCTSKCTSLCTSS
SCHEMBL17351827 0.83 ATM (0.52) ATMSYKCTSKCTSLCTSS
SCHEMBL15936982 0.83 ATM (0.52) ATMSYKCTSKCTSLCTSS
SCHEMBL25693847 0.82 ATM (0.51) ATMSYKCTSKCTSLCTSS
SCHEMBL4394493 0.80 ATM (0.56) ATMCTSKCTSLCTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050020588-A1 Cysteine protease inhibitors PEPTIMMUNE, INC. 2005-01-27 US disclosed
EP-1413580-A1 Furanone derivatives as inhibitors of Cathepsin S Medivir UK Ltd (GB) 2004-04-28 EP disclosed
EP-1178986-B1 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S MEDIVIR UK LTD (GB) 2004-02-25 EP disclosed
US-20030203900-A1 Cysteine protease inhibitors MEDIVIR UK LTD (GB) 2003-10-30 US disclosed
EP-1178986-A2 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S Medivir UK Ltd (GB) 2002-02-13 EP disclosed
WO-2000069855-A2 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S MEDIVIR UK LIMITED (GB) 2000-11-23 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 (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-20050020588-A1 Cysteine protease inhibitors CTSS, CTSE, CTSV ATM 2255/4885SYK 442/4885CTSK 4/4885
US-20030203900-A1 Cysteine protease inhibitors CTSS, CTSE, CTSV ATM 2255/4885SYK 442/4885CTSK 4/4885

“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.