SCHEMBL7793130

SCHEMBL7793130

C=CCOc1ccc(/C=N/N=C/c2ccc(Cl)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.51
KMT2A Q03164 5/20 0.50
NPC1 O15118 3/20 0.50
NPSR1 Q6W5P4 3/20 0.50
RAB9A P51151 2/20 0.50
UBE2N P61088 2/20 0.50
HPGD P15428 2/20 0.50
LMNA P02545 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CCR6 P51684 1/20 0.50
TP53 P04637 1/20 0.47
ALDH1A1 P00352 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
GRIN2D O15399 2/20 0.42
GRIN3B O60391 2/20 0.42
GRIN1 Q05586 2/20 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
SCHEMBL7793132 1.00 GAA (0.51) GAAKMT2ANPC1NPSR1RAB9A
SCHEMBL7783586 0.91 GAA (0.58) GAAKMT2ANPC1RAB9AHPGD
SCHEMBL7783588 0.91 GAA (0.58) GAAKMT2ANPC1RAB9AHPGD
SCHEMBL3453122 0.86 CA12 (0.53) GAAKMT2ANPC1RAB9AHPGD
SCHEMBL7792219 0.83 GAA (0.51) GAAKMT2ANPC1RAB9ALMNA
SCHEMBL7793050 0.83 GAA (0.51) GAAKMT2ANPC1RAB9ATP53
SCHEMBL7792609 0.83 NPC1 (0.57) GAAKMT2ANPC1RAB9AHPGD
SCHEMBL7792215 0.83 GAA (0.51) GAAKMT2ANPC1RAB9ALMNA
SCHEMBL7793048 0.83 GAA (0.51) GAAKMT2ANPC1RAB9ATP53
SCHEMBL7792604 0.83 NPC1 (0.57) GAAKMT2ANPC1RAB9AHPGD

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