SCHEMBL7082985

SCHEMBL7082985

CC(=O)OCC(O)COc1ccc2cc(OCC(O)COC(C)=O)ccc2c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.56
NPSR1 Q6W5P4 2/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.50
CYP1A2 P05177 1/20 0.49
RAB9A P51151 2/20 0.47
MAPK1 P28482 2/20 0.46
KDM1A O60341 2/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL7082811 0.90 MAPT (0.68) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL7087149 0.87 MAPK1 (0.55) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL7090368 0.85 MAPT (0.62) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL18382506 0.83 POLB (0.60) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL18234059 0.83 POLB (0.43) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL7083240 0.82 LMNA (0.58) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL7084425 0.82 MAPT (0.58) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL7088132 0.82 MAPT (0.58) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL18234071 0.82 MAPK1 (0.42) POLBNPSR1LMNAMAPTSMN1; SMN2
SCHEMBL6351413 0.81 MAPT (0.57) POLBNPSR1LMNAMAPTSMN1; SMN2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030149219-A1 Process for manufacturing a hydroxyester derivative intermediate and epoxy resins prepared therefrom BORIACK CLINTON J (US) 2003-08-07 US claimed
US-6534621-B2 Epoxidizing an alpha-halohydrin intermediate produced from an in situ halide substitution-deesterification of an alpha-hydroxy ester derivative DOW GLOBAL TECHNOLOGIES INC. 2003-03-18 US claimed
US-20020045707-A1 Process for manufacturing a hydroxyester derivative intermediate and epoxy resins prepared therefrom DOW GLOBAL TECHNOLOGIES INC. 2002-04-18 US claimed
US-20030149219-A1 Process for manufacturing a hydroxyester derivative intermediate and epoxy resins prepared therefrom BORIACK CLINTON J (US) 2003-08-07 US disclosed
US-6534621-B2 Epoxidizing an alpha-halohydrin intermediate produced from an in situ halide substitution-deesterification of an alpha-hydroxy ester derivative DOW GLOBAL TECHNOLOGIES INC. 2003-03-18 US disclosed
US-20020045707-A1 Process for manufacturing a hydroxyester derivative intermediate and epoxy resins prepared therefrom DOW GLOBAL TECHNOLOGIES INC. 2002-04-18 US disclosed