SCHEMBL6566737

SCHEMBL6566737

CCCCCCCCCC(=O)OC(=O)C(Cl)(Cl)Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.52
LMNA P02545 2/20 0.48
PAM P19021 2/20 0.47
TSHR P16473 5/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.46
MAPK1 P28482 1/20 0.46
CES2 O00748 3/20 0.45
CES1 P23141 3/20 0.45
PPARG P37231 4/20 0.43
PPARD Q03181 4/20 0.43
PPARA Q07869 4/20 0.43
GPR84 Q9NQS5 3/20 0.43
HDAC11 Q96DB2 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.43
SLC22A8 Q8TCC7 1/20 0.43
TLR2 O60603 1/20 0.43
MEN1 O00255 1/20 0.43
ESR1 P03372 1/20 0.43

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
SCHEMBL6563206 0.98 DGKA (0.50) DGKALMNAPAMTSHRALDH1A1
SCHEMBL7925508 0.98 DGKA (0.50) DGKALMNAPAMTSHRALDH1A1
SCHEMBL6563223 0.98 DGKA (0.50) DGKALMNAPAMTSHRALDH1A1
SCHEMBL11143611 0.96 DGKA (0.47) DGKALMNAPAMTSHRALDH1A1
SCHEMBL8343500 0.94 DGKA (0.50) DGKALMNAPAMTSHRALDH1A1
SCHEMBL8343499 0.94 DGKA (0.50) DGKALMNAPAMTSHRALDH1A1
SCHEMBL28106605 0.92 ALDH1A1 (0.44) DGKALMNAPAMTSHRALDH1A1
SCHEMBL8882128 0.82 DGKA (0.53) DGKALMNAPAMTSHRALDH1A1
SCHEMBL8883996 0.82 DGKA (0.53) DGKALMNAPAMTSHRALDH1A1
SCHEMBL31155339 0.82 DGKA (0.53) DGKALMNAPAMTSHRALDH1A1

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-0958267-B1 HIGHLY BRANCHED PRIMARY ALCOHOL COMPOSITIONS, AND BIODEGRADABLE DETERGENTS MADE THEREFROM SHELL INT RESEARCH (NL) 2004-03-31 EP disclosed
EP-0958267-A1 HIGHLY BRANCHED PRIMARY ALCOHOL COMPOSITIONS, AND BIODEGRADABLE DETERGENTS MADE THEREFROM SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1999-11-24 EP disclosed
WO-1998023566-A1 HIGHLY BRANCHED PRIMARY ALCOHOL COMPOSITIONS, AND BIODEGRADABLE DETERGENTS MADE THEREFROM SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1998-06-04 WO disclosed
EP-0024971-B1 NICKEL CARBOXYLATES, THEIR PREPARATION, THEIR USE IN A CATALYTIC COMPOSITION, THE USE OF THIS COMPOSITION IN THE OLIGOMERISATION OF MONOOLEFINES Institut Français du Pétrole (FR) 1982-12-15 EP disclosed
EP-0024971-A1 Nickel carboxylates, their preparation, their use in a catalytic composition, the use of this composition in the oligomerisation of monoolefines Institut Français du Pétrole (FR) 1981-03-11 EP disclosed