SCHEMBL9067016

SCHEMBL9067016

COC[CH]c1ccccc1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.39
GRIN2D O15399 2/20 0.39
GRIN3B O60391 2/20 0.39
GRIN1 Q05586 2/20 0.39
GRIN2A Q12879 2/20 0.39
GRIN2B Q13224 2/20 0.39
GRIN2C Q14957 2/20 0.39
GRIN3A Q8TCU5 2/20 0.39
BACE1 P56817 2/20 0.38
ACHE P22303 1/20 0.38
AKT1 P31749 1/20 0.36
DPP4 P27487 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
HTR7 P34969 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 4/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPK1 P28482 2/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL1864858 0.79 GRIN2D (0.43) ADRB2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4720996 0.74 GRIN2D (0.40) ADRB2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL27644891 0.74 GRIN2D (0.42) ADRB2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3128296 0.74 FLT3 (0.41) ADRB2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5012502 0.72 PTGS2 (0.38) ADRB2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5750248 0.72 TP53 (0.38) AKT1ALDH1A1MAPK1MAPTTP53
SCHEMBL4196373 0.72 NFE2L2 (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6041126 0.72 SOAT1 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2841427 0.71 GRIN2D (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6822813 0.71 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0441383-B1 Use of a copolymer for the making of contact lenses MITSUBISHI RAYON CO (JP) 1996-05-08 EP disclosed
US-5183870-A A curable polybutylene glycol di(meth)acrylate, a urethane or epoxy (meth)acrylate and a (meth)acrylate; heat and water resistance; impact strength; dyeability; workability MITSUBISHI RAYON CO., LTD (JP) 1993-02-02 US disclosed
EP-0441383-A2 Use of a copolymer for the making of contact lenses MITSUBISHI RAYON CO., LTD. (JP) 1991-08-14 EP disclosed