SCHEMBL6860166

SCHEMBL6860166

CCCCCCCCC(CC(=O)O)[N+](C)(CCO)C(CCCCCCCC)CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.50
PSMD14 O00487 2/20 0.47
PLA2G1B P04054 2/20 0.47
MMP2 P08253 2/20 0.47
ATG4B Q9Y4P1 2/20 0.47
HSP90AA1 P07900 2/20 0.47
RAD52 P43351 1/20 0.47
DNM1 Q05193 2/20 0.42
FFAR1 O14842 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
MAPT P10636 2/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
MEN1 O00255 1/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL4464049 0.92 PPARG (0.46) GPR84MMP2FFAR1FFAR4MAPT
SCHEMBL6675439 0.88 GPR84 (0.40) GPR84PSMD14PLA2G1BMMP2ATG4B
SCHEMBL4465833 0.82 FFAR1 (0.39) MMP2FFAR1FFAR4MAPTPPARD
Ethylene Glycol SCHEMBL5136577 0.72 GPR84 (0.60) GPR84FFAR1FFAR4MAPTLCK
Ethylene Glycol SCHEMBL5138346 0.72 GPR84 (0.60) GPR84FFAR1FFAR4MAPTLCK
Ethylene Glycol SCHEMBL5137218 0.72 GPR84 (0.60) GPR84FFAR1FFAR4MAPTLCK
Ethylene Glycol SCHEMBL5137927 0.72 GPR84 (0.60) GPR84FFAR1FFAR4MAPTLCK
Bicarbonate SCHEMBL26105638 0.71 GPR84 (0.52) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL5171531 0.70 GPR84 (0.58) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL8991255 0.70 GPR84 (0.58) GPR84FFAR1FFAR4MAPTLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040258649-A1 Aqueous formulations comprising combinations of anionic and cationic surfactants for generating a yeild point GOLDSCHMIDT AG (DE) 2004-12-23 US disclosed