SCHEMBL7791828

SCHEMBL7791828

C=CCc1ccc(C=NN=Cc2ccc(CC=C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
CYP3A4 P08684 3/20 0.47
TP53 P04637 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
ALOX12 P18054 1/20 0.47
MAPT P10636 4/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 1/20 0.42
XDH P47989 1/20 0.42
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 2/20 0.41
GABRA1 P14867 2/20 0.41
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 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
SCHEMBL7791826 1.00 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7791430 0.90 SMN1; SMN2 (0.63) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7789204 0.90 GRIN2D (0.46) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7789200 0.90 GRIN2D (0.46) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7783380 0.90 GRIN2D (0.46) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7791429 0.90 SMN1; SMN2 (0.63) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7793221 0.90 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7783383 0.90 GRIN2D (0.46) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7793218 0.90 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15
SCHEMBL7789212 0.87 GRIN2D (0.45) ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15

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