SCHEMBL8208799

SCHEMBL8208799

CC(C)(C)OC(=O)N[C@H](CC1CCC1)[C@@H](O)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.47
CTSS P25774 2/20 0.47
REN P00797 11/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
AAK1 Q2M2I8 2/20 0.40
CTSD P07339 1/20 0.39
CTSE P14091 1/20 0.39
HTRA1 Q92743 1/20 0.39
KMT2A Q03164 1/20 0.38
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38

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
SCHEMBL13592480 1.00 CTSK (0.47) CTSKCTSSRENCA1CA2
SCHEMBL8211616 1.00 CTSK (0.47) CTSKCTSSRENCA1CA2
SCHEMBL7860632 1.00 CTSK (0.47) CTSKCTSSRENCA1CA2
SCHEMBL13592481 1.00 CTSK (0.47) CTSKCTSSRENCA1CA2
SCHEMBL27076694 0.94 CTSK (0.49) CTSKCTSSRENCA1CA2
SCHEMBL9831856 0.88 CTSS (0.50) CTSKCTSSRENCA1CA2
SCHEMBL2809379 0.88 CTSK (0.51) CTSKCTSSRENCA1CA2
SCHEMBL13347448 0.88 CTSK (0.48) CTSKCTSSRENCA1CA2
SCHEMBL13347447 0.88 CTSK (0.48) CTSKCTSSRENCA1CA2
SCHEMBL12161411 0.88 CTSK (0.51) CTSKCTSSRENCA1CA2

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-20100113821-A1 PREPARATION OF 3-AMINO-3-(CYCLOBUTYLMETHYL)-2-(HYDROXY)-PROPIONAMIDE HYDROCHLORIDE SCHERING-PLOUGH CORPORATION (US) 2010-05-06 US disclosed
US-20090312576-A1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF 3-(AMINO)-3-CYCLOBUTYLMETHYL-2-HYDROXY-PROPIONAMIDE OR SALTS THEREOF SCHERING CORPORATION 2009-12-17 US disclosed
US-20090312576-A1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF 3-(AMINO)-3-CYCLOBUTYLMETHYL-2-HYDROXY-PROPIONAMIDE OR SALTS THEREOF SCHERING CORPORATION 2009-12-17 US disclosed
US-7595419-B2 Process and intermediates for the preparation of 3-(amino)-3-cyclobutylmethyl-2-hydroxy-propionamide or salts thereof SCHERING CORPORATION (US) 2009-09-29 US disclosed
US-7595419-B2 Process and intermediates for the preparation of 3-(amino)-3-cyclobutylmethyl-2-hydroxy-propionamide or salts thereof SCHERING CORPORATION (US) 2009-09-29 US disclosed
WO-2008082486-A2 PREPARATION OF 3-AMINO-3-(CYCLOBUTYLMETHYL)-2-(HYDROXY)-PROPIONAMIDE HYDROCHLORIDE SCHERING CORPORATION (US) 2008-07-10 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-20090312576-A1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF 3-(AMINO)-3-CYCLOBUTYLMETHYL-2-HYDROXY-PROPIONAMIDE OR SALTS THEREOF PCCA, IDH3A, ALDH18A1 CTSK 3678/4885CTSS 2837/4885REN 99/4885
US-20100113821-A1 PREPARATION OF 3-AMINO-3-(CYCLOBUTYLMETHYL)-2-(HYDROXY)-PROPIONAMIDE HYDROCHLORIDE CTRL, DNPEP, DPP3 CTSK 319/4885CTSS 42/4885REN 669/4885

“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.