SCHEMBL21242344

SCHEMBL21242344

CNc1ccc(/N=N/c2ccc(/C=C/c3ccc(/N=N/c4ccc(NC)cc4)cc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
APP P05067 16/20 0.61
KCNH2 Q12809 2/20 0.52
CA12 O43570 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
ADRA2A P08913 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45
MAT2A P31153 1/20 0.45

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
SCHEMBL10270322 0.90 APP (0.53) APPKCNH2CA12CA2CA9
SCHEMBL900823 0.86 APP (0.77) APPKCNH2MAT2A
SCHEMBL9678907 0.86 APP (0.77) APPKCNH2MAT2A
SCHEMBL19003408 0.86 APP (0.77) APPKCNH2MAT2A
SCHEMBL9680312 0.86 APP (0.77) APPKCNH2MAT2A
SCHEMBL3813225 0.86 CA12 (0.63) APPCA12CA2CA9ADRA2A
SCHEMBL3813221 0.86 CA12 (0.63) APPCA12CA2CA9ADRA2A
SCHEMBL18938003 0.83 CA12 (0.53) APPKCNH2CA12CA2CA9
SCHEMBL21466115 0.79 CA12 (0.57) APPCA12CA2CA9ADRA2A
SCHEMBL9679312 0.79 APP (0.68) APPKCNH2MAT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10442931-B2 Dye compound, composition comprising dye compound, and display device using dye compound SAMSUNG DISPLAY CO. LTD. (KR) 2019-10-15 US disclosed
EP-3412734-B1 DYE COMPOUND, COMPOSITION COMPRISING THE DYE COMPOUND, AND DISPLAY DEVICE USING THE DYE COMPOUND SAMSUNG DISPLAY CO LTD (KR) 2019-08-07 EP disclosed