SCHEMBL1734893

SCHEMBL1734893

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC(=O)C(=O)OC(=O)C(=O)CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.54
CES1 P23141 4/20 0.54
FAAH O00519 2/20 0.47
FFAR4 Q5NUL3 1/20 0.46
FFAR1 O14842 1/20 0.46
LMNA P02545 3/20 0.45
GPR84 Q9NQS5 2/20 0.43
CA2 P00918 1/20 0.43
TSHR P16473 2/20 0.42
CYP3A4 P08684 1/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42

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
SCHEMBL28523083 0.88 CES2 (0.68) CES2CES1FAAHFFAR4FFAR1
SCHEMBL7869102 0.88 CES2 (0.68) CES2CES1FAAHFFAR4FFAR1
SCHEMBL201429 0.81 LMNA (0.55) FFAR4FFAR1LMNATSHRCYP3A4
SCHEMBL8597775 0.80 FFAR4 (0.57) CES2CES1FAAHFFAR4FFAR1
SCHEMBL21114377 0.80 CES1 (0.65) CES2CES1FAAHGPR84TSHR
SCHEMBL28006875 0.79 CES1 (0.60) CES2CES1FAAHFFAR4FFAR1
SCHEMBL4541491 0.79 CES2 (0.60) CES2CES1FAAHLMNAGPR84
SCHEMBL30966190 0.78 KMT2A (0.61) CES2CES1FFAR4FFAR1LMNA
SCHEMBL6455810 0.78 KMT2A (0.61) CES2CES1FFAR4FFAR1LMNA
SCHEMBL28787958 0.77 CES1 (0.58) CES2CES1FAAHFFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778363-B1 STABLE GEL-FORMULATION WITH INCREASED ELECTROLYTE CONCENTRATION HENKEL AG & CO KGAA (DE) 2012-08-01 EP claimed
EP-1986590-B1 RHEOPEXY GELS AS VEHICLES HENKEL AG & CO KGAA (DE) 2011-11-16 EP claimed
WO-2011131915-A2 DEVICE FOR SHUTTING OFF A CONTROL SYSTEM BAY WITH PROXIMITY SENSOR NAVAG (FR) 2011-10-27 WO claimed
EP-1986592-A2 OXIDATIVE HAIR TREATING AGENT HAVING A GINSENG EXTRACT Henkel AG & Co. KGaA (DE) 2008-11-05 EP claimed
EP-1986590-A2 RHEOPEXY GELS AS VEHICLES Henkel AG & Co. KGaA (DE) 2008-11-05 EP claimed
WO-2007093271-A2 RHEOPEXY GELS AS VEHICLES HENKEL AG & CO. KGAA (DE) 2007-08-23 WO claimed
WO-2007090527-A2 OXIDATIVE HAIR TREATING AGENT HAVING A GINSENG EXTRACT HENKEL AG & CO. KGAA (DE) 2007-08-16 WO claimed
EP-1778363-A1 STABLE GEL-FORMULATION WITH INCREASED ELECTROLYTE CONCENTRATION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-05-02 EP claimed
WO-2006015650-A1 STABLE GEL-FORMULATION WITH INCREASED ELECTROLYTE CONCENTRATION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-02-16 WO claimed