SCHEMBL17879692

SCHEMBL17879692

O=C(O)CN(CCCCN(CC(=O)O)CC(=O)OCc1ccccc1)CC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 12/20 0.60
CA2 P00918 12/20 0.60
CA4 P22748 4/20 0.59
ALDH1A1 P00352 3/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CCR6 P51684 1/20 0.45
PAX8 Q06710 1/20 0.45

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
SCHEMBL3093075 0.94 CA1 (0.68) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL13589983 0.94 CA1 (0.68) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL9162085 0.92 CA1 (0.68) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL17879693 0.90 CA1 (0.66) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL17879683 0.90 CA1 (0.66) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL28893742 0.89 HTT (0.52) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL339168 0.89 ALDH1A1 (0.61) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL20272291 0.87 CA1 (0.49) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL13089902 0.87 CA1 (0.50) CA1CA2CA4ALDH1A1MAPK1
SCHEMBL20510397 0.87 CA1 (0.55) CA1CA2CA4ALDH1A1MAPK1

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
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