SCHEMBL16666243

SCHEMBL16666243

[CH2]C(C)(c1cccc(Oc2ccc(C(=O)O)c(C(=O)O)c2)c1)c1cccc(Oc2ccc(C(=O)O)c(C(=O)O)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.51
HPSE Q9Y251 1/20 0.51
TDP1 Q9NUW8 4/20 0.50
DUSP3 P51452 1/20 0.50
PTPN5 P54829 1/20 0.50
PTPN11 Q06124 1/20 0.50
NPC1 O15118 1/20 0.48
CYP2C9 P11712 1/20 0.48
RAB9A P51151 1/20 0.48
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.46
GALK1 P51570 1/20 0.46
CASP6 P55212 1/20 0.46
MCL1 Q07820 1/20 0.46
PLEC Q15149 1/20 0.46
AKR1C3 P42330 3/20 0.44
PYGM P11217 2/20 0.43
MAPK1 P28482 1/20 0.42
GFER P55789 1/20 0.42
APEX1 P27695 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
SCHEMBL29907832 0.88 POLB (0.54) POLBHPSETDP1DUSP3PTPN5
SCHEMBL1099667 0.88 POLB (0.54) POLBHPSETDP1DUSP3PTPN5
SCHEMBL16666226 0.87 POLB (0.55) POLBHPSETDP1DUSP3PTPN5
SCHEMBL8501229 0.82 HPSE (0.48) POLBHPSETDP1DUSP3PTPN5
SCHEMBL29393214 0.81 POLB (0.67) POLBHPSETDP1DUSP3PTPN5
SCHEMBL140780 0.81 POLB (0.67) POLBHPSETDP1DUSP3PTPN5
SCHEMBL7637726 0.81 POLB (0.67) POLBHPSETDP1DUSP3PTPN5
SCHEMBL29779713 0.80 POLB (0.51) POLBHPSETDP1DUSP3PTPN5
SCHEMBL8906676 0.80 POLB (0.55) POLBHPSETDP1DUSP3PTPN5
SCHEMBL1100529 0.80 POLB (0.51) POLBHPSETDP1DUSP3PTPN5

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
EP-2865702-B1 POLYIMIDE PRECURSOR, POLYIMIDE, FLEXIBLE SUBSTRATE USING SAME, COLOR FILTER AND MANUFACTURING METHOD THEREFOR, AND FLEXIBLE DISPLAY DEVICE TORAY INDUSTRIES (JP) 2016-12-14 EP disclosed
US-9493614-B2 Polyimide precursor, polyimide, flexible substrate prepared therewith, color filter and production method thereof, and flexible display device TORAY INDUSTRIES, INC. (JP) 2016-11-15 US disclosed
US-20160002407-A1 POLYIMIDE PRECURSOR, POLYIMIDE, FLEXIBLE SUBSTRATE PREPARED THEREWITH, COLOR FILTER AND PRODUCTION METHOD THEREOF, AND FLEXIBLE DISPLAY DEVICE TORAY INDUSTRIES, INC. (JP) 2016-01-07 US disclosed
EP-2865702-A1 POLYIMIDE PRECURSOR, POLYIMIDE, FLEXIBLE SUBSTRATE USING SAME, COLOR FILTER AND MANUFACTURING METHOD THEREFOR, AND FLEXIBLE DISPLAY DEVICE Toray Industries, Inc. (JP) 2015-04-29 EP disclosed