SCHEMBL4336760

SCHEMBL4336760

CC(C)CCCC(C)CCOc1ccc(-c2cc(CCl)c(-c3ccc(OCCC(C)CCCC(C)C)cc3)cc2CCl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.43
RARB P10826 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
ALOX5 P09917 1/20 0.40
MGAM O43451 2/20 0.39
GAA P10253 2/20 0.39
SI P14410 2/20 0.39
MGAM2 Q2M2H8 2/20 0.39
MAPK1 P28482 1/20 0.38
EPHX2 P34913 1/20 0.36
GGPS1 O95749 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR5 Q9H228 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
GSTO1 P78417 1/20 0.35
TP53 P04637 1/20 0.34
LMNA P02545 1/20 0.33
HTR1A P08908 1/20 0.33
HTR1D P28221 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
SCHEMBL6857091 0.94 FDPS (0.40) FDPSRARBTDP1ALOX5MGAM
SCHEMBL4329423 0.92 MGAM (0.43) FDPSRARBTDP1ALOX5MGAM
SCHEMBL1446870 0.89 TDP1 (0.42) FDPSRARBTDP1ALOX5MGAM
SCHEMBL5885700 0.88 FDPS (0.46) FDPSRARBTDP1ALOX5MGAM
SCHEMBL1446490 0.87 TDP1 (0.44) FDPSRARBTDP1ALOX5MGAM
SCHEMBL5885805 0.86 FDPS (0.39) FDPSRARBTDP1ALOX5GGPS1
SCHEMBL1446492 0.85 TDP1 (0.42) FDPSRARBTDP1ALOX5MAPK1
SCHEMBL6860165 0.84 FDPS (0.42) FDPSRARBTDP1ALOX5MGAM
SCHEMBL6860303 0.83 TDP1 (0.36) FDPSTDP1ALOX5GGPS1MAPT
SCHEMBL2565984 0.83 RARB (0.41) FDPSRARBTDP1ALOX5MGAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975710-B2 POLYMER ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2009-06-10 EP disclosed
US-7041388-B1 Substituted poly(arylene vinylenes), process for their preparation and their use in electroluminescent devices SEMICONDUCTORS GMBH (DE) 2006-05-09 US disclosed
EP-1232225-B1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR THE PRODUCTION THEREOF AND THEIR USE IN ELECTROLUMINESCENT DEVICES COVION ORGANIC SEMICONDUCTORS (DE) 2004-12-01 EP disclosed
EP-1232225-A1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR THE PRODUCTION THEREOF AND THEIR USE IN ELECTROLUMINESCENT DEVICES Covion Organic Semiconductors GmbH (DE) 2002-08-21 EP disclosed
WO-2001034722-A1 SUBSTITUTED POLY(ARYLENE VINYLENES), METHOD FOR THE PRODUCTION THEREOF AND THEIR USE IN ELECTROLUMINESCENT DEVICES COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2001-05-17 WO disclosed