SCHEMBL13637285

SCHEMBL13637285

C/N=C1/C=CC=C/C1=N/Nc1cc(Cl)ccc1CCCCOc1ccc(CC(=O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 1/20 0.38
LTB4R Q15722 9/20 0.37
LTB4R2 Q9NPC1 7/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PLA2G4A P47712 2/20 0.36
FFAR1 O14842 2/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL13637199 0.87 LTB4R (0.42) PLA2G4BLTB4RLTB4R2MEN1KMT2A
SCHEMBL13637162 0.72 LTB4R (0.40) PLA2G4BLTB4RLTB4R2PPARGPPARD
SCHEMBL13637279 0.69 PPARD (0.35) MEN1KMT2AL3MBTL1PPARGPPARD
SCHEMBL11596852 0.67 PLA2G4B (0.56) PLA2G4BLTB4RLTB4R2MEN1KMT2A
SCHEMBL11684213 0.66 PLA2G4B (0.69) PLA2G4BLTB4RLTB4R2FFAR1ALDH1A1
SCHEMBL13441623 0.64 LTB4R (0.46) PLA2G4BLTB4RLTB4R2MEN1KMT2A
SCHEMBL3468511 0.63 PLA2G4B (0.58) PLA2G4BLTB4RLTB4R2L3MBTL1FFAR1
SCHEMBL8219005 0.62 PLA2G4B (0.83) PLA2G4BALDH1A1LMNA
SCHEMBL3467363 0.62 PLA2G4B (0.60) PLA2G4BLTB4RLTB4R2FFAR1ALDH1A1
SCHEMBL4209775 0.62 PLA2G4B (0.60) PLA2G4BLTB4RLTB4R2FFAR1ALDH1A1

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-7622491-B2 Type 2 diabetes, atherosclerosis, cardiovascular disease, Syndrome X; carboxylic acids with dialkyldiether or thioether linking groups e.g. {4-[3-(2-Benzotriazol-2-yl-4-chloro-phenoxy)-propoxy]-phenyl}-acetic acid and {4-[3-(2-benzotriazol-2-yl-4-thiophen-2-yl-phenoxy)-propoxy]-phenyl}-acetic acid METABOLEX INC. (US) 2009-11-24 US disclosed