SCHEMBL3699388

SCHEMBL3699388

CCCCOOC(=O)CCC(C)(CCCC)CCCC

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.35
ALDH1A1 P00352 2/20 0.34
PAM P19021 2/20 0.33
ATM Q13315 1/20 0.32
NAAA Q02083 1/20 0.32
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
DNM1 Q05193 1/20 0.30
LMNA P02545 3/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL248558 0.86 DGKA (0.37) DGKAALDH1A1PAMATMNAAA
SCHEMBL1116614 0.83 DGKA (0.35) DGKAALDH1A1ATMNAAAHPGD
SCHEMBL28043998 0.81 DGKA (0.45) DGKAALDH1A1ATMNAAAHPGD
SCHEMBL31311137 0.81 NAAA (0.40) DGKANAAACES2CES1DNM1
SCHEMBL4735510 0.79 ALDH1A1 (0.48) DGKAALDH1A1ATMNAAAHPGD
SCHEMBL5698407 0.79 DGKA (0.48) DGKAALDH1A1PAMATMNAAA
SCHEMBL25218388 0.78 DGKA (0.46) DGKAALDH1A1PAMNAAATSHR
SCHEMBL574866 0.78 DGKA (0.46) DGKAALDH1A1PAMNAAATSHR
SCHEMBL1403265 0.77 DGKA (0.57) DGKAALDH1A1PAMTSHRCES2
SCHEMBL4225380 0.77 ALDH1A1 (0.46) DGKAALDH1A1ATMNAAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007018394-A9 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG CHEM, LTD. (KR) 2010-12-02 WO claimed
EP-1913081-A1 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG Chem. Ltd. (KR) 2008-04-23 EP claimed
WO-2007018394-A1 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG CHEM, LTD. (KR) 2007-02-15 WO claimed
WO-2007018394-A9 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG CHEM, LTD. (KR) 2010-12-02 WO disclosed
EP-1913081-A1 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG Chem. Ltd. (KR) 2008-04-23 EP disclosed
WO-2007018394-A1 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG CHEM, LTD. (KR) 2007-02-15 WO disclosed