SCHEMBL6860165

SCHEMBL6860165

CC(C)CCCC(C)CCOc1ccc(-c2cc(CO)c(Cl)cc2CO)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.42
RARB P10826 1/20 0.41
ALOX5 P09917 1/20 0.39
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
FFAR1 O14842 2/20 0.37
FFAR4 Q5NUL3 2/20 0.37
MAPK1 P28482 1/20 0.36
GGPS1 O95749 1/20 0.35
EPHX2 P34913 1/20 0.35
S1PR1 P21453 2/20 0.35
S1PR5 Q9H228 1/20 0.35
GSTO1 P78417 1/20 0.35
CYP2C9 P11712 1/20 0.33
SCN5A Q14524 1/20 0.33
SRD5A2 P31213 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL5885700 0.93 FDPS (0.46) FDPSRARBALOX5MGAMGAA
SCHEMBL6857091 0.88 FDPS (0.40) FDPSRARBALOX5MGAMGAA
SCHEMBL6859290 0.85 MGAM (0.47) FDPSRARBALOX5MGAMGAA
SCHEMBL4336760 0.84 FDPS (0.43) FDPSRARBALOX5MGAMGAA
SCHEMBL7526851 0.82 ALOX5 (0.44) FDPSRARBALOX5MGAMGAA
SCHEMBL5885814 0.81 FDPS (0.41) FDPSRARBALOX5TDP1GGPS1
SCHEMBL2570786 0.78 RARB (0.44) FDPSRARBALOX5MGAMGAA
SCHEMBL4329423 0.77 MGAM (0.43) FDPSRARBALOX5MGAMGAA
SCHEMBL1446870 0.77 TDP1 (0.42) FDPSRARBALOX5MGAMGAA
SCHEMBL6858939 0.76 FDPS (0.38) FDPSALOX5TDP1GGPS1GSTO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1029019-B1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR PRODUCING THE SAME, AND THEIR USE IN ELECTROLUMINESCENT ELEMENTS COVION ORGANIC SEMICONDUCTORS (DE) 2004-03-03 EP disclosed
US-6638646-B2 Polymerizing one or more monomers containing dihalogen containing substituted biaryls, via a base-induced dehydrohalogenation SEMICONDUCTORS GMBH (DE) 2003-10-28 US disclosed
US-20030088050-A1 Substituted poly(arylenevinylenes), process for their preparation, and their use in electroluminescent elements MERCK PATENT GMBH (DE) 2003-05-08 US disclosed
US-20020064680-A1 Substituted poly(arylene vinylenes), method for producing the same, and their use in electroluminescent elements AXIVA GMBH (DE) 2002-05-30 US disclosed
EP-1029019-A1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR PRODUCING THE SAME, AND THEIR USE IN ELECTROLUMINESCENT ELEMENTS Axiva GmbH (DE) 2000-08-23 EP disclosed
WO-1999024526-A1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR PRODUCING THE SAME, AND THEIR USE IN ELECTROLUMINESCENT ELEMENTS AXIVA GMBH (DE) 1999-05-20 WO disclosed