SCHEMBL4623399

SCHEMBL4623399

CCCCCCCCCCCCC(O)COc1[c]cccc1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.38
ADRB1 P08588 1/20 0.38
PTPN1 P18031 1/20 0.37
SOAT1 P35610 3/20 0.36
CSNK1E P49674 1/20 0.36
PLA2G4B P0C869 1/20 0.36
S1PR1 P21453 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP2D6 P10635 1/20 0.34
GPR84 Q9NQS5 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PTPN11 Q06124 1/20 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
SCHEMBL8487258 0.81 MEN1 (0.39) ADRB2ADRB1CSNK1EPLA2G4BKDM4E
SCHEMBL8388913 0.76 MAPT (0.35) ADRB2ADRB1MAPTHTTKDM4E
SCHEMBL8487255 0.76 KMT2A (0.39) ADRB2ADRB1KDM4E
SCHEMBL27838229 0.75 ADRB2 (0.59) ADRB2ADRB1MAPTKDM4ECYP2D6
SCHEMBL21990 0.74 PLA2G4B (0.55) ADRB2ADRB1PLA2G4BS1PR1MAPT
SCHEMBL6231558 0.74 PLA2G4B (0.55) ADRB2ADRB1PLA2G4BS1PR1MAPT
SCHEMBL382120 0.74 PLA2G4B (0.55) ADRB2ADRB1PLA2G4BS1PR1MAPT
SCHEMBL9797915 0.74 PLA2G4B (0.55) ADRB2ADRB1PLA2G4BS1PR1MAPT
SCHEMBL9797717 0.74 PLA2G4B (0.55) ADRB2ADRB1PLA2G4BS1PR1MAPT
SCHEMBL5621754 0.74 ALDH1A1 (0.38) ADRB2ADRB1MAPTKDM4ECYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1280868-B1 RIGID SUBSTRATE LAMINATION ADHESIVE 3M INNOVATIVE PROPERTIES CO (US) 2008-05-07 EP disclosed
US-6706403-B1 Rigid substrate lamination adhesive 3M INNOVATIVE PROPERTIES COMPANY 2004-03-16 US disclosed
EP-1280868-A1 RIGID SUBSTRATE LAMINATION ADHESIVE 3M Innovative Properties Company (US) 2003-02-05 EP disclosed
WO-2001088053-A1 RIGID SUBSTRATE LAMINATION ADHESIVE 3M INNOVATIVE PROPERTIES COMPANY (US) 2001-11-22 WO disclosed
WO-2001087595-A1 RIGID SUBSTRATE LAMINATION PROCESS, SYSTEM, AND PRODUCT 3M INNOVATIVE PROPERTIES COMPANY (US) 2001-11-22 WO disclosed