SCHEMBL5070462

SCHEMBL5070462

C=C(C)C(=O)NC(C)(C)CC(C)N(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.34
GRIN2D O15399 2/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33
GRIN2B Q13224 2/20 0.33
GRIN2C Q14957 2/20 0.33
OPRM1 P35372 2/20 0.33
CACNA1F O60840 1/20 0.33
ABCB1 P08183 1/20 0.33
CYP2B6 P20813 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
CACNA1D Q01668 1/20 0.33
CACNA1S Q13698 1/20 0.33
CACNA1C Q13936 1/20 0.33
MRGPRX2 Q96LB1 1/20 0.33
CHRNB2 P17787 4/20 0.33
CHRNA4 P43681 4/20 0.33

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
SCHEMBL1071550 0.82 TGFBR1 (0.36) TGFBR1RXFP1
SCHEMBL4951496 0.80 TGFBR1 (0.35) TGFBR1RXFP1
SCHEMBL27972962 0.76 TGFBR1 (0.33) TGFBR1RXFP1
SCHEMBL5225500 0.76 ALDH1A1 (0.44) KCNH2GRIN2DGRIN1GRIN2AGRIN2B
SCHEMBL19881206 0.75 TGFBR1 (0.34) TGFBR1RXFP1
SCHEMBL6649327 0.75 TSHR (0.38) TGFBR1
SCHEMBL10833650 0.74 IMPDH2 (0.33) TGFBR1
SCHEMBL5074775 0.71 ALDH1A1 (0.32) OPRM1DRD4DRD3TGFBR1
SCHEMBL21251495 0.71 TGFBR1 (0.34) TGFBR1RXFP1
SCHEMBL9805999 0.71 EPHX1 (0.40) TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1174444-B1 Dispersion stablizer for suspension polymerization of vinyl compound KURARAY CO LTD KURASHIKI PLANT (JP) 2008-05-21 EP disclosed
EP-1300421-B1 Dispersion stabilizer for suspension polymerization of vinyl compound KURARAY CO (JP) 2005-08-31 EP disclosed
US-6806305-B2 ETHYLENE-VINYL ALCOHOL COPOLYMER KURARAY CO., LTD. (JP) 2004-10-19 US disclosed
US-6635709-B2 For suspension polymerization stability upon providing an effect that polymer scales are less adhered to an inner wall of a polymerization vessels KURARAY CO., LTD. (JP) 2003-10-21 US disclosed
US-20030092835-A1 Dispersion stabilizer for suspension polymerization of vinyl compound KURARAY CO. LTD. (JP) 2003-05-15 US disclosed
EP-1300421-A1 Dispersion stabilizer for suspension polymerization of vinyl compound KURARAY CO., LTD. (JP) 2003-04-09 EP disclosed
US-20030008972-A1 Dispersion stabilizer for suspension polymerization of vinyl compound KURARAY CO. LTD. (JP) 2003-01-09 US disclosed
EP-1174444-A1 Dispersion stablizer for suspension polymerization of vinyl compound Kuraray Co., Ltd., Kurashiki Plant (JP) 2002-01-23 EP disclosed