SCHEMBL2313669

SCHEMBL2313669

CC[C@H](NC(=O)OC(C)(C)C)C(O)=S

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 14/20 0.60
CTSS P25774 12/20 0.60
CTSL P07711 2/20 0.47
CTSB P07858 2/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL5270143 1.00 CTSK (0.60) CTSKCTSSCTSLCTSBCYP1A2
SCHEMBL8542752 1.00 CTSK (0.60) CTSKCTSSCTSLCTSBCYP1A2
SCHEMBL29813427 0.86 CTSK (0.62) CTSKCTSSCTSLCTSBCYP1A2
SCHEMBL3966187 0.86 CTSK (0.62) CTSKCTSSCTSLCTSBCYP1A2
SCHEMBL29695964 0.86 CTSK (0.62) CTSKCTSSCTSLCTSBCYP1A2
SCHEMBL1951491 0.85 CTSK (0.64) CTSKCTSSCTSLCTSBCYP1A2
SCHEMBL318796 0.85 CTSK (0.64) CTSKCTSSCTSLCTSBCYP1A2
SCHEMBL835996 0.85 CTSK (0.64) CTSKCTSSCTSLCTSBCYP1A2
SCHEMBL27041621 0.83 CTSK (0.64) CTSKCTSS
SCHEMBL27041617 0.83 CTSK (0.64) CTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1846366-B1 NORVALINE DERIVATIVE AND METHOD FOR PREPARATION THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2011-08-03 EP disclosed
US-7718703-B2 Norvaline derivative and method for preparation thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-05-18 US disclosed
US-20080076769-A1 Norvaline Derivative and Method for Preparation Thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-03-27 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-20080076769-A1 Norvaline Derivative and Method for Preparation Thereof SLC38A7, SLC7A1, SLC6A7 CTSK 3976/4885CTSS 3274/4885CTSL 3582/4885

“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.