SCHEMBL5033341

SCHEMBL5033341

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
KMT2A Q03164 1/20 0.53
GRIK1 P39086 2/20 0.41
GRIA4 P48058 2/20 0.41
GRIK3 Q13003 2/20 0.41
GRIK5 Q16478 2/20 0.41
GRM8 O00222 1/20 0.41
GRM6 O15303 1/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GSR P00390 1/20 0.41
CYP1A2 P05177 1/20 0.41
GRM5 P41594 1/20 0.41
GRIA1 P42261 1/20 0.41
GRIA2 P42262 1/20 0.41
GRIA3 P42263 1/20 0.41
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 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
SCHEMBL726834 0.89 ALOX15 (0.52) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL29286626 0.89 GRM8 (0.54) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL29240009 0.89 BLM (0.57) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL3411544 0.89 BLM (0.57) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL204796 0.89 ALOX15 (0.52) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL711607 0.88 ALOX15 (0.60) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL28313344 0.88 ALOX15 (0.60) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL9452863 0.85 ALOX15 (0.48) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL1276948 0.85 SLC1A1 (0.41) ALOX15BLMPMP22KMT2AGRIK1
SCHEMBL1653844 0.84 SLC22A6 (0.39) GRIK1GRIA4GRIK3GRIK5GRM8

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
CN-106133024-B The novel hydrotrote based on polymer for hydrophobic drug delivering 日东电工株式会社 2019-07-05 CN disclosed
EP-1969031-A1 POLYGLUTAMATE-AMINO ACID CONJUGATES AND METHODS Nitto Denko Corporation (JP) 2008-09-17 EP disclosed
WO-2007067417-A1 POLYGLUTAMATE-AMINO ACID CONJUGATES AND METHODS NITTO DENKO CORPORATION (JP) 2007-06-14 WO disclosed