SCHEMBL28265256

SCHEMBL28265256

N#Cc1cccc([CH]C=O)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 3/20 0.53
GRIN2D O15399 2/20 0.47
GRIN3B O60391 2/20 0.47
GRIN1 Q05586 2/20 0.47
GRIN2A Q12879 2/20 0.47
GRIN2B Q13224 2/20 0.47
GRIN2C Q14957 2/20 0.47
GRIN3A Q8TCU5 2/20 0.47
P4HB P07237 9/20 0.46
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
MAOA P21397 3/20 0.41
MAOB P27338 3/20 0.41
ENPP2 Q13822 1/20 0.41
GSK3B P49841 1/20 0.40

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
SCHEMBL67236 0.83 FBP1 (0.56) FBP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29463498 0.83 FBP1 (0.56) FBP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1435468 0.81 FBP1 (0.58) FBP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1435469 0.81 FBP1 (0.58) FBP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1687910 0.79 FBP1 (0.65) FBP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2774364 0.79 FBP1 (0.65) FBP1GRIN2DGRIN3BGRIN1GRIN2A
Cyclopropane SCHEMBL29130088 0.78 FBP1 (0.51) FBP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL18002842 0.77 FBP1 (0.58) FBP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2657660 0.77 FBP1 (0.53) FBP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9190941 0.76 FBP1 (0.57) FBP1GRIN2DGRIN3BGRIN1GRIN2A

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
CN-109071504-A Inhibitors of receptor interacting protein kinase 1 戴纳立制药公司 2018-12-21 CN disclosed