SCHEMBL4447838

SCHEMBL4447838

CCCCC(CCCC)C(=O)OC(=O)/C=C/C(=O)OC(=O)C(CCCC)CCCC

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.50
CA1 P00915 4/20 0.50
ATM Q13315 2/20 0.50
TSHR P16473 3/20 0.46
MAPK1 P28482 1/20 0.45
HCAR2 Q8TDS4 4/20 0.44
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 1/20 0.41
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HPGD P15428 1/20 0.38

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
SCHEMBL4447846 0.93 HCAR2 (0.56) CA2CA1ATMTSHRMAPK1
SCHEMBL4447841 0.93 HCAR2 (0.56) CA2CA1ATMTSHRMAPK1
SCHEMBL28413287 0.88 HDAC1 (0.44) CA2CA1ATMTSHRHCAR2
SCHEMBL29617539 0.81 HCAR2 (0.53) ATMTSHRHCAR2TDP1CYP3A4
SCHEMBL8678597 0.79 CA2 (0.53) CA2CA1ATMTSHRMAPK1
SCHEMBL27494921 0.79 CA2 (0.59) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL2775912 0.78 CA2 (0.58) CA2CA1ATMTSHRMAPK1
SCHEMBL28409240 0.78 CA2 (0.52) CA2CA1ATMTSHRMAPK1
SCHEMBL243206 0.78 CA2 (0.52) CA2CA1ATMTSHRMAPK1
SCHEMBL3075648 0.77 CA2 (0.55) CA2CA1MAPK1SLC1A2SLC1A1

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-1773937-A4 PROCESSING AID FOR PVC AND METHOD FOR MANUFACTURING THE SAME LG CHEMICAL LTD (KR) 2009-01-14 EP claimed
US-20080139713-A1 A methyl methacrylate copolymer plasticizer or internal lubricant; microemulsification with a ultrahydrophobe, a plasticizer or an internal lubricant, an emulsifier, and an initiator; emulsion copolymerization, spray drying; increased melt speed and processability LG CHEM, LTD. (KR) 2008-06-12 US claimed
EP-1773937-A1 PROCESSING AID FOR PVC AND METHOD FOR MANUFACTURING THE SAME LG Chem, Ltd. (KR) 2007-04-18 EP claimed
WO-2006062366-A1 PROCESSING AID FOR PVC AND METHOD FOR MANUFACTURING THE SAME LG CHEM, LTD. (KR) 2006-06-15 WO claimed
EP-1773937-A4 PROCESSING AID FOR PVC AND METHOD FOR MANUFACTURING THE SAME LG CHEMICAL LTD (KR) 2009-01-14 EP disclosed
US-20080139713-A1 A methyl methacrylate copolymer plasticizer or internal lubricant; microemulsification with a ultrahydrophobe, a plasticizer or an internal lubricant, an emulsifier, and an initiator; emulsion copolymerization, spray drying; increased melt speed and processability LG CHEM, LTD. (KR) 2008-06-12 US disclosed
EP-1773937-A1 PROCESSING AID FOR PVC AND METHOD FOR MANUFACTURING THE SAME LG Chem, Ltd. (KR) 2007-04-18 EP disclosed
WO-2006062366-A1 PROCESSING AID FOR PVC AND METHOD FOR MANUFACTURING THE SAME LG CHEM, LTD. (KR) 2006-06-15 WO disclosed