SCHEMBL21574844

SCHEMBL21574844

N#Cc1cccc(/C=C\c2ccc(/C=C\c3cccc(C#N)c3)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 3/20 0.61
P4HB P07237 9/20 0.53
GRIN2D O15399 2/20 0.50
GRIN3B O60391 2/20 0.50
GRIN1 Q05586 2/20 0.50
GRIN2A Q12879 2/20 0.50
GRIN2B Q13224 2/20 0.50
GRIN2C Q14957 2/20 0.50
GRIN3A Q8TCU5 2/20 0.50
MAOA P21397 2/20 0.47
MAOB P27338 2/20 0.47
NFE2L2 Q16236 1/20 0.45
CYP19A1 P11511 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
SCHEMBL9186668 1.00 FBP1 (0.61) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL9186663 1.00 FBP1 (0.61) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL1687907 0.96 FBP1 (0.57) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL21574806 0.96 FBP1 (0.57) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL9190221 0.96 FBP1 (0.57) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL1687873 0.96 FBP1 (0.57) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL2774364 0.96 FBP1 (0.65) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL1687910 0.96 FBP1 (0.65) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL10661672 0.94 FBP1 (0.59) FBP1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL1405482 0.94 FBP1 (0.59) FBP1P4HBGRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3911687-B1 LIMONENE-BASED (METH)ACRYLATES FOR USE IN 3D PRINTING BASF SE (DE) 2023-11-01 EP disclosed
WO-2021032518-A1 A PROCESS FOR THE PRODUCTION OF FINGERPRINT TEXTURE FREE LIQUID CRYSTAL FILMS BASF SE (DE) 2021-02-25 WO disclosed
WO-2020148190-A1 HYDROXYURETHANE (METH)ACRYLATE PREPOLYMERS FOR USE IN 3D PRINTING BASF SE (DE) 2020-07-23 WO disclosed
WO-2020148189-A1 LIMONENE-BASED (METH)ACRYLATES FOR USE IN 3D PRINTING BASF SE (DE) 2020-07-23 WO disclosed
EP-3680263-A1 LIMONENE-BASED (METH)ACRYLATES FOR USE IN 3D PRINTING BASF SE (DE) 2020-07-15 EP disclosed
EP-3680274-A1 HYDROXYURETHANE (METH)ACRYLATE PREPOLYMERS FOR USE IN 3D PRINTING BASF SE (DE) 2020-07-15 EP disclosed
EP-2561038-B1 POLYMERIZED FILMS WITH LINE TEXTURE OR FINGERPRINT TEXTURE BASF SE (DE) 2019-11-20 EP disclosed