SCHEMBL6320220

SCHEMBL6320220

CCCCCCCCCCCCCCCCCCC(S)(CCCCCCCCCCCCCCCCCC)C(S)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 5/20 0.42
FFAR1 O14842 1/20 0.42
PPARD Q03181 4/20 0.41
MAPT P10636 2/20 0.41
LCK P06239 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
CES2 O00748 1/20 0.40
GRIK1 P39086 1/20 0.40
GRIK2 Q13002 1/20 0.40
KMT2A Q03164 2/20 0.39
ACE2 Q9BYF1 1/20 0.39
PPARG P37231 3/20 0.39
PPARA Q07869 3/20 0.39
TSHR P16473 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
SLC22A8 Q8TCC7 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
SCHEMBL7956322 0.81 HSPD1 (0.41) GPR84FFAR1PPARDMAPTKMT2A
SCHEMBL7956343 0.81 HSPD1 (0.41) GPR84FFAR1PPARDMAPTKMT2A
SCHEMBL7954246 0.81 HSPD1 (0.41) GPR84FFAR1PPARDMAPTKMT2A
SCHEMBL9434780 0.81 GRIK1 (0.43) GPR84FFAR1PPARDMAPTLCK
SCHEMBL5200142 0.74 CA2 (0.39) GPR84FFAR1PPARDMAPTLCK
Dodecane SCHEMBL6460928 0.72 GPR84 (0.54) GPR84FFAR1PPARDMAPTLCK
Octane SCHEMBL28026114 0.72 GPR84 (0.54) GPR84FFAR1PPARDMAPTLCK
SCHEMBL1043350 0.71 CES2 (0.45) GPR84FFAR1PPARDMAPTCES2
SCHEMBL933572 0.71 CES2 (0.45) GPR84FFAR1PPARDMAPTCES2
SCHEMBL11859866 0.71 CES2 (0.45) GPR84FFAR1PPARDMAPTCES2

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
US-20050101735-A1 Polymeric composition LUCITE INTERNATIONAL UK LIMITED (GB) 2005-05-12 US disclosed
US-20040157968-A1 Polymeric composition LUCITE INTERNATIONAL UK LIMITED (GB) 2004-08-12 US disclosed
US-20040063860-A1 Polymeric fibres LUCITE INTERNATIONAL UK LIMITED (GB) 2004-04-01 US disclosed
EP-1385907-A2 POLYMERIC COMPOSITION Lucite International UK Limited (GB) 2004-02-04 EP disclosed
EP-1383835-A2 POLYMERIC COMPOSITION Lucite International UK Limited (GB) 2004-01-28 EP disclosed
EP-1364082-A1 POLYMERIC FIBRES Lucite International UK Limited (GB) 2003-11-26 EP disclosed
WO-2002083788-A2 POLYMERIC COMPOSITION LUCITE INTERNATIONAL UK LIMITED (GB) 2002-10-24 WO disclosed
WO-2002083787-A2 POLYMERIC COMPOSITION LUCITE INTERNATIONAL UK LIMITED (GB) 2002-10-24 WO disclosed
WO-2002063079-A1 POLYMERIC FIBRES LUCITE INTERNATIONAL UK LIMITED (GB) 2002-08-15 WO disclosed