SCHEMBL2369331

SCHEMBL2369331

CC(C)CCCCCOc1c(C(C)(C)C)cc(C(C)(C)C)c2c1Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1OPO2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 3/20 0.34
CD14 P08571 3/20 0.34
LY96 Q9Y6Y9 3/20 0.34
ALOX5 P09917 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL6545688 0.89 TLR4 (0.36) TLR4CD14LY96
SCHEMBL77081 0.72 ALOX5 (0.34) TLR4CD14LY96ALOX5PTGS1
SCHEMBL29421151 0.72 ALOX5 (0.34) TLR4CD14LY96ALOX5PTGS1
SCHEMBL8633940 0.72 ELANE (0.35) TLR4CD14LY96
SCHEMBL29893946 0.71 ALOX5 (0.33) TLR4CD14LY96ALOX5PTGS1
SCHEMBL4338483 0.67 ALOX5 (0.32) ALOX5PTGS1PTGS2
SCHEMBL8907901 0.62 CNR1 (0.37) ALOX5PTGS1PTGS2
SCHEMBL29413911 0.60
SCHEMBL39578 0.60
SCHEMBL5051084 0.60 TLR4 (0.35) TLR4CD14LY96ALOX5PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103709732-B Polyamide molding composite and its purposes in moulding article production EMS专利股份公司 2017-11-17 CN disclosed
EP-2630166-A1 OLIGOMERIC LIGHT STABILIZERS WITH A SPECIFIC FUNCTIONALIZATION BASF SE (DE) 2013-08-28 EP disclosed
EP-2542526-A1 STERICALLY HINDERED AMINES BASF SE (DE) 2013-01-09 EP disclosed
WO-2012052376-A1 OLIGOMERIC LIGHT STABILIZERS WITH A SPECIFIC FUNCTIONALIZATION BASF SE (DE) 2012-04-26 WO disclosed
WO-2011107513-A1 STERICALLY HINDERED AMINES BASF SE (DE) 2011-09-09 WO disclosed
EP-2032577-A1 LONG WAVELENGTH SHIFTED BENZOTRIAZOLE UV-ABSORBERS AND THEIR USE Ciba Holding Inc. (CH) 2009-03-11 EP disclosed
WO-2008000646-A1 LONG WAVELENGTH SHIFTED BENZOTRIAZOLE UV-ABSORBERS AND THEIR USE CIBA HOLDING INC. (CH) 2008-01-03 WO disclosed
EP-1791901-A2 STABILIZATION OF ORGANIC MATERIALS Ciba SC Holding AG (CH) 2007-06-06 EP disclosed
WO-2006024611-A2 STABILIZATION OF ORGANIC MATERIALS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-03-09 WO disclosed
EP-1440117-A2 POLYESTER AND POLYAMIDE COMPOSITIONS OF LOW RESIDUAL ALDEHYDE CONTENT Ciba SC Holding AG (CH) 2004-07-28 EP disclosed
WO-2003031507-A2 POLYESTER AND POLYAMIDE COMPOSITIONS OF LOW RESIDUAL ALDEHYDE CONTENT CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-04-17 WO disclosed