SCHEMBL8770868

SCHEMBL8770868

O=C(O)CC(O)c1ccccc1F

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.49
CES1 P23141 1/20 0.49
EEF2K O00418 3/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CNR2 P34972 1/20 0.46
GAA P10253 1/20 0.44
CTSA P10619 4/20 0.43
CYP3A4 P08684 1/20 0.41
FFAR1 O14842 1/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL8771339 0.85 CES2 (0.51) CES2CES1EEF2KMEN1KMT2A
SCHEMBL5685248 0.84 EEF2K (0.50) CES2CES1EEF2KMEN1KMT2A
SCHEMBL11495829 0.81 CES2 (0.46) CES2CES1EEF2KMEN1KMT2A
SCHEMBL2457680 0.79 EEF2K (0.47) CES2CES1EEF2KMEN1KMT2A
SCHEMBL7236109 0.79 EEF2K (0.47) CES2CES1EEF2KMEN1KMT2A
SCHEMBL3511352 0.79 EEF2K (0.47) CES2CES1EEF2KMEN1KMT2A
SCHEMBL6443530 0.79 EEF2K (0.50) CES2CES1EEF2KMEN1KMT2A
SCHEMBL28032089 0.79 MEN1 (0.44) CES2CES1MEN1KMT2ACNR2
SCHEMBL8770892 0.79 MEN1 (0.44) CES2CES1MEN1KMT2ACNR2
SCHEMBL30556756 0.78 AKR1B1 (0.45) CYP1A2TSHR

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
EP-0451668-B1 Process for the production of optically active alkyl 3-aryl-3-hydroxypropionates CHISSO CORP (JP) 1997-08-13 EP disclosed
US-5202457-A Enzyme catalyzed transesterification, resolution of optical active alkyl 3-aryl-3-hydroxypropionate CHISSO CORPORATION (JP) 1993-04-13 US disclosed
EP-0451668-A2 Optically active alkyl 3-aryl-3-hydroxypropionates and a method for producing thereof CHISSO CORPORATION (JP) 1991-10-16 EP disclosed