SCHEMBL6097359

SCHEMBL6097359

[CH2]CC(C)(C)NCC(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
CA14 Q9ULX7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
PTPRC P08575 2/20 0.33
DGAT1 O75907 1/20 0.33
CYP2D6 P10635 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
CA1 P00915 1/20 0.30
CA7 P43166 1/20 0.30

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
SCHEMBL756932 0.79 CA2 (0.39) CA2CA12CA14L3MBTL1PTPRC
SCHEMBL3772506 0.75 CA2 (0.37) CA2CA12CA14L3MBTL1PTPRC
SCHEMBL7442333 0.74 GAA (0.42) L3MBTL1MEN1GAAKMT2A
SCHEMBL21564883 0.73 CA2 (0.36) CA2CA12CA14L3MBTL1PTPRC
SCHEMBL2842538 0.73 RECQL (0.41) CA2CA12CA14L3MBTL1PTPRC
SCHEMBL23894059 0.73 CA2 (0.41) CA2CA12CA14L3MBTL1PTPRC
SCHEMBL783009 0.73 CA2 (0.41) CA2CA12CA14L3MBTL1PTPRC
SCHEMBL21625398 0.73 DGAT1 (0.36) CA2CA12CA14L3MBTL1PTPRC
SCHEMBL7660753 0.72 PTPRC (0.39) CA2CA12CA14L3MBTL1PTPRC
SCHEMBL7428244 0.72 DGAT1 (0.47) CA2CA12CA14L3MBTL1PTPRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109352-B2 Process for producing optically active amino acid derivatives KANEKA CORPORATION (JP) 2006-09-19 US disclosed
US-20050143586-A1 Process for producing optically active amino acid derivatives KANEKA CORPORATION (JP) 2005-06-30 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-20050143586-A1 Process for producing optically active amino acid derivatives NPEPPS, AAAS, DDC CA2 286/4885CA12 1984/4885CA14 2621/4885

“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.