SCHEMBL7793250

SCHEMBL7793250

C=CCCCCc1ccc(/C=N/N=C/c2ccc(C#N)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
GAA P10253 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37

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
SCHEMBL7793254 1.00 MEN1 (0.44) MEN1KMT2ATSHRHSD17B10CA12
SCHEMBL7791266 0.96 MEN1 (0.45) MEN1KMT2ATSHRHSD17B10CA12
SCHEMBL7791269 0.96 MEN1 (0.45) MEN1KMT2ATSHRHSD17B10CA12
SCHEMBL7789258 0.90 MEN1 (0.47) MEN1KMT2ATSHRHSD17B10CA12
SCHEMBL7789255 0.90 MEN1 (0.47) MEN1KMT2ATSHRHSD17B10CA12
SCHEMBL7789052 0.88 GRIN2D (0.44) MEN1KMT2ACA1CA2CA9
SCHEMBL7789049 0.88 GRIN2D (0.44) MEN1KMT2ACA1CA2CA9
SCHEMBL9458406 0.83 TSHR (0.50) TSHRHSD17B10CA12CA1CA2
SCHEMBL7792195 0.83 GRIN1 (0.45) CA1CA2CA9SMN1; SMN2RAB9A
SCHEMBL7792198 0.83 GRIN1 (0.45) CA1CA2CA9SMN1; SMN2RAB9A

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