SCHEMBL8770968

SCHEMBL8770968

CCOC(=O)CC(O)c1cc(OC)cc(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.47
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 1/20 0.44
FGFR2 P21802 3/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
FGFR3 P22607 2/20 0.41
FGFR1 P11362 1/20 0.41
FGFR4 P22455 1/20 0.41
KDR P35968 1/20 0.41
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
TACR1 P25103 1/20 0.39
THRB P10828 1/20 0.38

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
SCHEMBL8770878 0.85 L3MBTL1 (0.68) L3MBTL1ALDH1A1ALOX15TSHRMAPK1
SCHEMBL8771183 0.85 L3MBTL1 (0.50) SMN1; SMN2L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL24643324 0.84 ALOX15 (0.57) L3MBTL1ALDH1A1ALOX15HPGDKMT2A
SCHEMBL4811149 0.84 ALOX15 (0.57) L3MBTL1ALDH1A1ALOX15HPGDKMT2A
SCHEMBL8770956 0.80 L3MBTL1 (0.51) L3MBTL1ALDH1A1POLBKMT2ATACR1
SCHEMBL8770966 0.79 L3MBTL1 (0.46) SMN1; SMN2L3MBTL1TACR1
SCHEMBL8771047 0.79 GPR35 (0.39) ALDH1A1CYP3A4HPGDTSHRMAPK1
SCHEMBL8771001 0.79 ALDH1A1 (0.38) SMN1; SMN2L3MBTL1ALDH1A1HPGDTSHR
SCHEMBL8770949 0.79 CES2 (0.40) ALDH1A1TSHRKMT2A
SCHEMBL5849064 0.78 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1ALDH1A1ALOX15FGFR2

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