SCHEMBL7945239

SCHEMBL7945239

COC(=O)N[C@H](C=O)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.38
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32

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
SCHEMBL1994082 0.85 CTSK (0.34) CTSK
SCHEMBL22749258 0.83 CTSK (0.54) CTSKCA1CA2CA7
SCHEMBL806058 0.83 CTSK (0.54) CTSKCA1CA2CA7
SCHEMBL8135670 0.82 CTSK (0.38) CTSKCA1CA2CA7
SCHEMBL23253063 0.81 TSHR (0.31) CA1CA2CA7
SCHEMBL20468983 0.80 CTSK (0.33) CTSK
SCHEMBL10170123 0.80 LMNA (0.39) CTSK
SCHEMBL8300175 0.80 CTSK (0.37) CTSKCA1CA2CA7
SCHEMBL8300173 0.77 SMN1; SMN2 (0.44) CTSKCA1CA2CA7
SCHEMBL12140942 0.77 CTSK (0.38) CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018145021-A1 ATAZANAVIR (ATV) ANALOGUES FOR TREATING HIV INFECTIONS GILEAD SCIENCES, INC. (US) 2018-08-09 WO disclosed
US-20120115918-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2012-05-10 US disclosed
US-20110195940-A1 Protease Inhibitors Having Enhanced Features NEKTAR THERAPEUTICS (CA) 2011-08-11 US disclosed
EP-2340830-A2 Hepatitis C Virus Inhibitors Bristol-Myers Squibb Company (US) 2011-07-06 EP disclosed
US-20110071093-A1 Novel Reagents NEKTAR THERAPEUTICS (US) 2011-03-24 US disclosed
WO-2010144869-A2 PROTEASE INHIBITORS NEKTAR THERAPEUTICS (US) 2010-12-16 WO disclosed
WO-2010033219-A2 PROTEASE INHIBITORS HAVING ENHANCED FEATURES NEKTAR THERAPEUTICS (US) 2010-03-25 WO disclosed
US-20090270499-A1 Process for Synthesizing Atazanavir OXYRANE (UK) LIMITED (UK) 2009-10-29 US disclosed
WO-2009130534-A1 PROCESS FOR SYNTHESIZING ATAZANAVIR OXYRANE (PTY) LTD. (ZA) 2009-10-29 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 (4 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-20110071093-A1 Novel Reagents DNPEP, NGLY1, COG7 CTSK 1039/4885CA1 990/4885CA2 3546/4885
US-20120115918-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS CTSK 632/4885CA1 4852/4885CA2 4674/4885
US-20110195940-A1 Protease Inhibitors Having Enhanced Features CYP3A43, HPN, ANPEP CTSK 127/4885CA1 3657/4885CA2 4472/4885
US-20090270499-A1 Process for Synthesizing Atazanavir SAMHD1, TYMS, COASY CTSK 1705/4885CA1 4788/4885CA2 4651/4885

“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.