SCHEMBL7789060

SCHEMBL7789060

COc1ccc(C=NN=Cc2ccc(OCC(F)(F)F)c(F)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
CYP3A4 P08684 1/20 0.47
HPGD P15428 1/20 0.47
CYP2C19 P33261 1/20 0.47
ATM Q13315 1/20 0.47
MAPT P10636 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 1/20 0.41
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN1 Q05586 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2B Q13224 2/20 0.40
GRIN2C Q14957 2/20 0.40
GRIN3A Q8TCU5 2/20 0.40
MIF P14174 1/20 0.40
CHRM5 P08912 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 2/20 0.39

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
SCHEMBL7789057 1.00 KMT2A (0.56) KMT2AMEN1CYP3A4HPGDCYP2C19
SCHEMBL7788757 0.87 NPC1 (0.46) KMT2AMEN1CYP3A4HPGDCYP2C19
SCHEMBL7788756 0.87 NPC1 (0.46) KMT2AMEN1CYP3A4HPGDCYP2C19
SCHEMBL7789038 0.86 KMT2A (0.49) KMT2AMEN1CYP3A4HPGDCYP2C19
SCHEMBL7789033 0.86 KMT2A (0.49) KMT2AMEN1CYP3A4HPGDCYP2C19
SCHEMBL7788378 0.85 KMT2A (0.41) KMT2AMEN1CYP3A4HPGDCYP2C19
SCHEMBL7788380 0.85 KMT2A (0.41) KMT2AMEN1CYP3A4HPGDCYP2C19
SCHEMBL7792357 0.83 MAPT (0.54) KMT2AMEN1MAPTCYP1A2GRIN2D
SCHEMBL7793513 0.83 KMT2A (0.56) KMT2AMEN1CYP3A4HPGDCYP2C19
SCHEMBL7792352 0.83 MAPT (0.54) KMT2AMEN1MAPTCYP1A2GRIN2D

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-0825176-B1 Azine derivative, process for the preparation thereof, nematic liquid crystal composition and liquid crystal display system comprising same DAINIPPON INK & CHEMICALS (JP) 2001-11-14 EP disclosed
US-6010642-A LIGHT SCATTERING LIQUID CRYSTAL DISPLAY DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-01-04 US disclosed
EP-0825176-A1 Azine derivative, process for the preparation thereof, nematic liquid crystal composition and liquid crystal display system comprising same DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-02-25 EP disclosed