SCHEMBL21160100

SCHEMBL21160100

CNC(C)(C)CCOC(C)(C)CC(C)(C)CC(C)(C)C(C)=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31

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
SCHEMBL15462687 0.75
SCHEMBL15172892 0.74 GAA (0.33) GAA
SCHEMBL20016625 0.74 ALDH1A1 (0.34) GAA
SCHEMBL24758244 0.74
SCHEMBL14064885 0.73 ALDH1A1 (0.31) GAA
SCHEMBL20694601 0.72 ACACB (0.31)
SCHEMBL12286986 0.71 GAA (0.30) GAA
SCHEMBL26593066 0.71 MAPK1 (0.35)
SCHEMBL9294282 0.71 GAA (0.40) GAA
SCHEMBL22212532 0.70 NAALAD2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2660249-B1 PEPTIDE DERIVATIVE AND USE THEREOF UNIV KYOTO (JP) 2019-07-10 EP disclosed