SCHEMBL17879697

SCHEMBL17879697

O=C(O)CN(CC(=O)OCCc1ccccc1)CC(=O)OCCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 9/20 0.68
CA2 P00918 9/20 0.68
CA4 P22748 2/20 0.60
TDP1 Q9NUW8 2/20 0.56
APP P05067 1/20 0.49
HCAR2 Q8TDS4 1/20 0.49
FFAR1 O14842 1/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
ALOX5 P09917 2/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
CYP3A4 P08684 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL17879675 0.90 CA1 (0.57) CA1CA2CA4TDP1FFAR1
SCHEMBL14797441 0.86 CA1 (0.64) CA1CA2CA4TDP1ESR1
SCHEMBL8886066 0.84 CA1 (0.58) CA1CA2CA4TDP1APP
SCHEMBL17879693 0.83 CA1 (0.66) CA1CA2CA4TDP1HCAR2
SCHEMBL17879683 0.83 CA1 (0.66) CA1CA2CA4TDP1HCAR2
SCHEMBL18843707 0.80 CA1 (0.68) CA1CA2CA4TDP1TSHR
SCHEMBL18843708 0.80 CA1 (0.68) CA1CA2CA4TDP1TSHR
SCHEMBL16488388 0.80 TDP1 (0.70) CA1CA2CA4TDP1APP
SCHEMBL2430757 0.79 TDP1 (0.63) TDP1APPHCAR2FFAR1ESR1
SCHEMBL451185 0.79 TDP1 (0.63) TDP1APPHCAR2FFAR1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10001584-B2 Optical film, and polarizing plate and liquid crystal display device that use this optical film FUJIFILM CORPORATION (JP) 2018-06-19 US disclosed
US-10001584-B2 Optical film, and polarizing plate and liquid crystal display device that use this optical film FUJIFILM CORPORATION (JP) 2018-06-19 US disclosed
US-20160187537-A1 OPTICAL FILM, AND POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE THAT USE THIS OPTICAL FILM FUJIFILM CORPORATION (JP) 2016-06-30 US disclosed
US-20160187537-A1 OPTICAL FILM, AND POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE THAT USE THIS OPTICAL FILM FUJIFILM CORPORATION (JP) 2016-06-30 US disclosed