SCHEMBL20767209

SCHEMBL20767209

CCOC(=O)C[C@H]1CCN(C(=O)O)C[C@H]1F

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.36
THRB P10828 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.34
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL20767257 1.00 GAA (0.38) GAAALDH1A1MAPTTHRBATM
SCHEMBL27008084 1.00 GAA (0.38) GAAALDH1A1MAPTTHRBATM
SCHEMBL6120347 1.00 GAA (0.38) GAAALDH1A1MAPTTHRBATM
SCHEMBL27008132 1.00 GAA (0.38) GAAALDH1A1MAPTTHRBATM
SCHEMBL13711178 0.90 GAA (0.45) GAAALDH1A1MAPTTHRBATM
SCHEMBL14501404 0.86 L3MBTL1 (0.40) GAAALDH1A1MAPTTHRBATM
SCHEMBL23421691 0.85 GAA (0.40) GAAALDH1A1MAPTTHRBATM
SCHEMBL27173005 0.85 BRD4 (0.35) GAAPOLBSMN1; SMN2
SCHEMBL23421304 0.85 GAA (0.40) GAAALDH1A1MAPTTHRBATM
SCHEMBL15227428 0.83 HPGD (0.42) GAAALDH1A1MAPTMEN1KMT2A

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
WO-2019040105-A2 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2019-02-28 WO disclosed