SCHEMBL4822309

SCHEMBL4822309

CC(C)(C)OC(=O)N1CCN[C@H](C(N)=O)C1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NR1H2 P55055 1/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
GPR119 Q8TDV5 4/20 0.39
RECQL P46063 1/20 0.38
EPHX1 P07099 1/20 0.38
KDM4E B2RXH2 1/20 0.38
THRB P10828 1/20 0.38
EPHX2 P34913 1/20 0.37
PDE4B Q07343 1/20 0.36

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
SCHEMBL3561676 1.00 USP2 (0.42) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL18129961 1.00 USP2 (0.42) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL27567585 0.87 USP2 (0.45) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL14959559 0.86 HPGD (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL14452943 0.86 HPGD (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL1184732 0.86 USP2 (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL2392691 0.86 USP2 (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL796400 0.86 USP2 (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL193100 0.86 USP2 (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL30289051 0.86 USP2 (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT

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
WO-2012123312-A1 PYRIDO[3,4-B]PYRAZINE DERIVATIVES AS SYK INHIBITORS GLAXO GROUP LIMITED (GB) 2012-09-20 WO disclosed
US-7365077-B2 Piperazine bis-amide derivatives and their use as antagonists of the orexin receptor SMITHKLINE BEECHAM P.L.C. (GB) 2008-04-29 US disclosed
US-20060252769-A1 Piperazine bis-amide derivatives and their use as antagonists of the orexin receptor SMTIHKLINE BEECHAM P.L.C. (GB) 2006-11-09 US disclosed
WO-2003051873-A1 PIPERAZINE COMPOUNDS AND THEIR PHAMACEUTICAL USE SMITHKLINE BEECHAM PLC (GB) 2003-06-26 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 (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-20060252769-A1 Piperazine bis-amide derivatives and their use as antagonists of the orexin receptor HCRTR2, HCRTR1, NPSR1 USP2 2478/4885SMN1; SMN2 3631/4885NR1H2 255/4885

“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.