SCHEMBL19067950

SCHEMBL19067950

C/C(=N\c1ccccc1C(C)C)c1ccc(/C(C)=N/c2ccccc2C(C)C)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.46
NOS3 P29474 2/20 0.46
NOS1 P29475 2/20 0.46
NOS2 P35228 2/20 0.46
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
GRIN1 Q05586 1/20 0.46
GRIN2A Q12879 1/20 0.46
GRIN2B Q13224 1/20 0.46
GRIN2C Q14957 1/20 0.46
GRIN3A Q8TCU5 1/20 0.46
SCN5A Q14524 1/20 0.40
SCN2A Q99250 1/20 0.40
GABRA1 P14867 2/20 0.38
GABRB2 P47870 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL5587070 1.00 SIGMAR1 (0.46) SIGMAR1NOS3NOS1NOS2GRIN2D
SCHEMBL19067858 0.81 MEN1 (0.47) SIGMAR1NOS3NOS1NOS2GRIN2D
SCHEMBL19067952 0.81 GABRA1 (0.41) SIGMAR1NOS3NOS1NOS2GRIN2D
SCHEMBL5590193 0.81 GABRA1 (0.41) SIGMAR1NOS3NOS1NOS2GRIN2D
SCHEMBL5587095 0.79 TRPA1 (0.40) SCN5ASCN2AKDM4EMEN1GAA
SCHEMBL7646738 0.77 SIGMAR1 (0.54) SIGMAR1NOS3NOS1NOS2GRIN2D
SCHEMBL22428393 0.77 SIGMAR1 (0.54) SIGMAR1NOS3NOS1NOS2GRIN2D
SCHEMBL7646734 0.77 SIGMAR1 (0.54) SIGMAR1NOS3NOS1NOS2GRIN2D
SCHEMBL5587466 0.77 SIGMAR1 (0.47) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5587467 0.77 SIGMAR1 (0.47) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9695260-B2 Method for producing olefin block polymer using plurality of types of transition metal catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-04 US disclosed