SCHEMBL7109586

SCHEMBL7109586

CC(C)CCCC(C)CCOc1ccc(-c2ccc(Cl)c(C(Cl)Cl)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.42
FDPS P14324 2/20 0.41
TDP1 Q9NUW8 2/20 0.39
ALOX5 P09917 1/20 0.39
GSTO1 P78417 1/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
MAPK1 P28482 1/20 0.35
GGPS1 O95749 1/20 0.34
EPHX2 P34913 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL7110866 0.89 RARB (0.44) RARBFDPSTDP1ALOX5GSTO1
SCHEMBL7114046 0.87 RARB (0.41) RARBFDPSTDP1ALOX5GSTO1
SCHEMBL6585486 0.81 ALOX5 (0.43) RARBFDPSTDP1ALOX5GSTO1
SCHEMBL7111616 0.79 TDP1 (0.37) RARBFDPSTDP1ALOX5GGPS1
SCHEMBL16340342 0.78 TDP1 (0.58) RARBFDPSTDP1ALOX5GSTO1
SCHEMBL6857008 0.78 TDP1 (0.58) RARBFDPSTDP1ALOX5GSTO1
SCHEMBL5886067 0.78 ALOX5 (0.40) FDPSTDP1ALOX5GSTO1MAPK1
SCHEMBL7114196 0.77 MEN1 (0.41) FDPSTDP1ALOX5GSTO1FFAR1
SCHEMBL7116628 0.77 FDPS (0.36) RARBFDPSTDP1ALOX5GSTO1
SCHEMBL6859293 0.76 RARB (0.43) RARBFDPSTDP1ALOX5GSTO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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