SCHEMBL2326421

SCHEMBL2326421

COC(=O)[C@@](C)(NC(C)=O)[C@@H](C)O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
DGAT1 O75907 1/20 0.34
ALDH1A1 P00352 3/20 0.34
PKM P14618 2/20 0.32
KDM4E B2RXH2 2/20 0.32
THRB P10828 1/20 0.32
KCNN4 O15554 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HTT P42858 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 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
SCHEMBL4121532 0.78 TP53 (0.32) ALDH1A1
SCHEMBL2185566 0.70 DGAT1 (0.41) DGAT1ALDH1A1KCNN4
SCHEMBL21605368 0.70 PIK3CD (0.35) KDM4E
SCHEMBL65055 0.70 DGAT1 (0.41) DGAT1ALDH1A1KCNN4
SCHEMBL2184251 0.70 DGAT1 (0.41) DGAT1ALDH1A1KCNN4
SCHEMBL12563721 0.70 ELANE (0.43) MAPTDGAT1ALDH1A1PKMKDM4E
SCHEMBL20959675 0.69 DGAT1 (0.39) DGAT1ALDH1A1KCNN4
Ammonia Solution, Strong SCHEMBL27748277 0.69 DGAT1 (0.39) DGAT1ALDH1A1KCNN4
SCHEMBL28232208 0.68 DGAT1 (0.40) DGAT1L3MBTL1TAS1R3TAS1R1
SCHEMBL23033819 0.67 DGAT1 (0.43) DGAT1KCNN4TAS1R3TAS1R1

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-2357248-A1 Method for producing optically active 2-(N-substituted aminomethyl)-3-hydroxybutyric acid ester KANEKA CORPORATION (JP) 2011-08-17 EP disclosed