SCHEMBL5839663

SCHEMBL5839663

CC(C)(c1ccccn1)C(N)N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
CHRM2 P08172 1/20 0.38
NOS3 P29474 2/20 0.38
NOS1 P29475 2/20 0.38
NOS2 P35228 2/20 0.38
PI4KA P42356 1/20 0.38
PI4K2B Q8TCG2 1/20 0.38
PI4K2A Q9BTU6 1/20 0.38
PI4KB Q9UBF8 1/20 0.38
HRH1 P35367 1/20 0.36
CHRM3 P20309 1/20 0.36
CYP1A2 P05177 2/20 0.36

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
SCHEMBL28341098 0.86 L3MBTL1 (0.47) SMN1; SMN2L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL2396116 0.81 GRIN2D (0.46) SMN1; SMN2L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL2395871 0.81 GRIN2D (0.46) SMN1; SMN2L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL2394588 0.81 GRIN2D (0.46) SMN1; SMN2L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL20809866 0.81 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1CHRM2NOS3NOS1
Hydrochloric Acid SCHEMBL2396348 0.80 GRIN2D (0.45) SMN1; SMN2L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL5839742 0.79 SMN1; SMN2 (0.44) SMN1; SMN2L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL12229498 0.76 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL1921572 0.76 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL1CHRM2NOS3NOS1
SCHEMBL29435883 0.76 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL1CHRM2NOS3NOS1

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-6992034-B2 Catalyst component for olefin polymerization FORMOSA PLASTICS CORPORATION, U.S.A. (US) 2006-01-31 US disclosed
US-20050009690-A1 Catalyst component for olefin polymerization FORMOSA PLASTICS CORPORATIONS, U.S.A. 2005-01-13 US disclosed