SCHEMBL9845138

SCHEMBL9845138

CCOc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OCC)c(O)c3O)cc2)c(O)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
KDM4E B2RXH2 4/20 0.54
ALOX15 P16050 4/20 0.54
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
HPGD P15428 3/20 0.47
HSD17B10 Q99714 3/20 0.47
ALDH1A1 P00352 2/20 0.47
RECQL P46063 2/20 0.47
KMT2A Q03164 5/20 0.42
CASP3 P42574 2/20 0.42
RAB9A P51151 2/20 0.42
SENP8 Q96LD8 2/20 0.42
SENP7 Q9BQF6 2/20 0.42
SENP6 Q9GZR1 2/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL14760916 0.80 MAPT (0.51) MAPTKDM4EALOX15HPGDHSD17B10
SCHEMBL28137387 0.78 KDM4E (0.84) MAPTKDM4EALOX15HPGDHSD17B10
SCHEMBL29415000 0.78 KDM4E (0.84) MAPTKDM4EALOX15HPGDHSD17B10
SCHEMBL9639024 0.75 KDM4E (0.63) MAPTKDM4EALOX15HPGDHSD17B10
SCHEMBL9714980 0.74 KDM4E (0.71) MAPTKDM4EALOX15HPGDHSD17B10
SCHEMBL9715029 0.74 MAPT (0.71) MAPTKDM4EALOX15HPGDHSD17B10
SCHEMBL12732139 0.74 KMT2A (0.62) MAPTESR1ESR2KMT2ARAB9A
SCHEMBL28683507 0.73 MAPT (0.69) MAPTKDM4EALOX15HPGDHSD17B10
SCHEMBL29415002 0.73 MAPT (0.69) MAPTKDM4EALOX15HPGDHSD17B10
SCHEMBL29415034 0.73 MAPT (0.66) MAPTKDM4EALOX15HPGDHSD17B10

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-0416288-A2 Reduction of acidity of polyesters by melt reaction endcapping BRIDGESTONE/FIRESTONE, INC. (US) 1991-03-13 EP disclosed
EP-0414009-A2 Reduction of acidity of polyesters by melt reaction endcapping with dialkyloxalate BRIDGESTONE/FIRESTONE, INC. (US) 1991-02-27 EP disclosed
EP-0414008-A2 Reduction of acidity of polyesters by melt reaction endcapping with enamines or schiff bases BRIDGESTONE/FIRESTONE, INC. (US) 1991-02-27 EP disclosed